data_2gs0_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 2gs0 _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 ' 2' ' ' SER . . . . . . . . . . . . . 53.3 m . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.799 0.333 . . . . 0.0 110.873 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 35.4 m80 63.29 33.58 13.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.287 0.565 . . . . 0.0 111.08 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.527 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 54.9 p 177.59 129.28 0.05 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.637 179.189 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -164.04 114.47 0.6 Allowed Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.598 -0.811 . . . . 0.0 112.335 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.594 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -43.7 100.57 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.165 0.507 . . . . 0.0 111.436 -179.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.476 ' O ' ' O ' ' A' ' 14' ' ' GLY . . . -116.54 154.71 29.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.909 -178.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.547 HG23 ' O ' ' A' ' 12' ' ' VAL . 1.0 OUTLIER -101.78 126.63 55.69 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 CA-C-O 121.105 0.479 . . . . 0.0 110.443 178.967 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.499 ' CD1' ' CE2' ' A' ' 89' ' ' PHE . 15.4 t80 -114.0 130.67 56.53 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.208 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.422 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 37.4 mt-10 55.73 35.08 24.63 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.024 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 28.2 mttm 76.24 1.28 3.39 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.394 -179.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.547 ' O ' HG23 ' A' ' 8' ' ' ILE . 42.1 t -99.6 156.68 3.94 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.644 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 178.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.526 ' HA ' HG13 ' A' ' 8' ' ' ILE . 91.1 p -98.86 149.68 22.66 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-O 121.435 0.636 . . . . 0.0 112.408 -178.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.476 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 174.53 -179.53 45.79 Favored Glycine 0 N--CA 1.447 -0.624 0 N-CA-C 110.281 -1.128 . . . . 0.0 110.281 -179.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.594 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.45 142.49 19.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 117.719 0.76 . . . . 0.0 110.493 179.368 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.527 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -106.63 118.29 54.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 179.784 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -120.19 136.83 54.5 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.17 0.51 . . . . 0.0 111.533 -178.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.424 ' CD1' HG22 ' A' ' 103' ' ' THR . 88.5 mt -109.95 140.03 30.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.095 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.8 t-20 -131.29 111.56 11.99 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.915 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -91.54 6.64 44.85 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.275 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 50.8 t0 -79.56 -17.99 52.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.921 0.391 . . . . 0.0 110.333 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -102.78 144.17 14.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.903 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 70.3 m -116.15 118.89 37.5 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.969 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.405 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 1.8 Cg_endo -80.84 137.88 40.98 Favored 'Cis proline' 0 C--N 1.348 0.519 0 C-N-CA 123.768 -1.347 . . . . 0.0 111.891 -0.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -42.95 140.61 1.33 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.068 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -132.46 167.06 20.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.213 0.53 . . . . 0.0 111.81 -179.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.2 tt -121.11 131.18 54.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.788 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 45.2 m -118.75 126.27 51.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.062 0.458 . . . . 0.0 112.047 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.479 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 62.2 t90 -100.43 128.14 46.57 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.814 178.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.02 118.8 27.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.841 0.353 . . . . 0.0 111.062 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 30.7 t -45.44 167.18 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.314 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.3 -42.78 53.95 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.491 0.662 . . . . 0.0 109.748 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -85.22 -17.83 35.88 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.91 -1.041 . . . . 0.0 111.109 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.74 33.9 12.25 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.359 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -98.83 -22.08 16.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.625 0.25 . . . . 0.0 111.568 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.12 144.11 40.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.989 0.423 . . . . 0.0 111.379 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 42.4 t -139.23 144.06 29.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.758 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.493 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 49.3 t60 -137.27 145.95 44.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.03 0.443 . . . . 0.0 111.415 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.2 m -128.77 137.87 51.78 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.797 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 88.5 t -135.98 140.86 43.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.997 0.427 . . . . 0.0 111.663 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.453 ' CG1' ' CG2' ' A' ' 44' ' ' THR . 1.7 p -83.25 117.36 28.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 177.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.489 ' HA ' HG12 ' A' ' 45' ' ' ILE . 85.8 mt -75.63 -34.27 60.55 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.162 -0.472 . . . . 0.0 112.187 -178.612 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.405 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 22.4 t -51.07 -24.62 4.07 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.031 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.453 ' CG2' ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -85.81 -23.7 27.09 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.816 0.341 . . . . 0.0 111.142 -179.693 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.489 HG12 ' HA ' ' A' ' 42' ' ' LEU . 41.9 mm -47.27 101.5 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.314 -179.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -95.25 -20.7 18.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.444 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.495 ' HB2' HG13 ' A' ' 63' ' ' ILE . 46.1 mtmt -153.33 138.58 17.47 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.939 0.399 . . . . 0.0 111.286 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.415 ' CD1' HD12 ' A' ' 108' ' ' ILE . 34.1 mt -109.59 124.35 50.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.899 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -109.91 130.48 55.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.398 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.401 ' CB ' ' CE ' ' A' ' 101' ' ' LYS . . . -145.81 138.95 26.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.097 -179.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 70.0 p -75.76 133.66 73.03 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.549 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.39 149.94 78.2 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.593 2.196 . . . . 0.0 112.443 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.02 -41.68 97.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.142 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 87.3 p -59.29 -26.17 64.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.867 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.9 t -87.73 118.91 27.55 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.874 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -57.7 -18.45 20.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.389 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 30.3 mmtt -65.51 110.07 2.57 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.995 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 19.0 mmm -94.49 123.9 38.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.44 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 11.5 ttm -177.18 160.42 1.73 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.224 0.535 . . . . 0.0 111.994 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.401 HD22 ' CE1' ' A' ' 91' ' ' PHE . 6.3 tp -148.46 123.91 10.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.86 179.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 33.0 mtt180 -116.47 136.68 52.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.141 0.496 . . . . 0.0 112.039 -178.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.424 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -111.55 131.0 55.55 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.884 179.02 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.495 HG13 ' HB2' ' A' ' 47' ' ' LYS . 1.0 OUTLIER -109.07 122.14 63.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.128 -179.365 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.58 145.96 17.89 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.354 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.9 mttt -58.62 158.82 7.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.854 0.359 . . . . 0.0 110.959 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.433 ' CG1' ' N ' ' A' ' 67' ' ' ASP . 1.1 p -121.55 -162.13 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.894 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.433 ' N ' ' CG1' ' A' ' 66' ' ' VAL . 5.3 m-20 -175.99 55.41 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.33 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -58.3 -21.55 49.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.279 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 35.6 m -59.58 -17.96 37.06 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.061 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -69.05 -38.75 79.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.043 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.3 mptt 59.62 92.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.819 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 43.0 mmt180 -95.2 140.87 29.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.991 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 26.1 mmtp -87.6 145.64 26.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.986 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -93.43 172.51 8.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.887 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -60.07 -19.98 55.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.328 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 51.2 mp0 -86.41 4.63 38.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.422 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.62 14.36 82.52 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.699 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -110.45 144.73 38.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.912 0.387 . . . . 0.0 110.948 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -70.96 148.97 47.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.105 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.436 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.1 m -132.21 158.83 43.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.932 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.5 t -102.66 98.62 11.43 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.671 178.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.436 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 85.0 Cg_exo -45.61 161.66 0.12 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.428 2.085 . . . . 0.0 112.546 -179.095 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -115.0 150.47 44.25 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.054 0.454 . . . . 0.0 110.978 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -72.56 147.41 45.87 Favored 'Trans proline' 0 N--CA 1.465 -0.164 0 C-N-CA 123.466 2.777 . . . . 0.0 112.728 -179.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -72.5 142.36 48.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.796 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 87.0 mtt180 -150.68 119.95 6.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.853 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -105.7 159.06 16.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.671 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.0 ttt -131.74 121.43 24.2 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.929 0.395 . . . . 0.0 111.33 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.499 ' CE2' ' CD1' ' A' ' 9' ' ' PHE . 91.8 m-85 -128.67 154.0 46.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.505 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 33.1 t -126.68 134.13 50.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.951 0.405 . . . . 0.0 111.141 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.475 ' CG ' ' HB3' ' A' ' 97' ' ' MET . 83.3 m-85 -120.37 162.07 20.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.48 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -109.43 -21.28 12.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.214 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -116.51 112.6 21.61 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.658 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -48.06 -29.38 3.5 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.02 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.5 -48.92 63.16 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.119 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 52.6 t -58.79 -52.73 56.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.416 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.475 ' HB3' ' CG ' ' A' ' 91' ' ' PHE . 4.0 ptm -62.91 -32.11 73.32 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.446 ' O ' ' HB3' ' A' ' 102' ' ' MET . 12.0 m-20 -63.63 -34.2 77.32 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.182 179.284 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -72.05 -44.18 63.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.483 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.443 HG13 ' CZ ' ' A' ' 91' ' ' PHE . 23.4 mm -60.14 -50.52 79.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.568 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.401 ' CE ' ' CB ' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -61.7 -30.92 71.06 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.939 179.855 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.446 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.1 OUTLIER -79.09 -43.72 23.55 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.506 179.83 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.424 HG22 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -67.47 -42.69 82.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.849 -179.801 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 35.9 mt -61.7 -39.49 91.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.556 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -60.86 -32.26 71.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.686 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -68.56 -29.48 68.05 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.812 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.402 ' CD1' ' CD1' ' A' ' 42' ' ' LEU . 23.4 mt -77.25 -50.44 20.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.319 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.451 ' H ' HG13 ' A' ' 108' ' ' ILE . 2.3 mt -56.58 -61.1 1.32 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.622 0 CA-C-O 121.749 0.785 . . . . 0.0 109.268 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.6 t -50.56 -28.83 9.37 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.394 -1.275 . . . . 0.0 110.574 179.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 2.2 mtt180 -65.66 -39.83 91.8 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.663 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -85.9 -30.05 23.16 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.592 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.6 mttt . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.465 179.486 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.0 m . . . . . 0 C--O 1.233 0.193 0 CA-C-O 120.843 0.354 . . . . 0.0 110.972 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.401 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 58.8 m80 -134.93 35.46 3.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.169 0.509 . . . . 0.0 110.927 -179.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.532 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 58.7 p -178.61 114.96 0.07 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.919 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.424 ' O ' ' C ' ' A' ' 6' ' ' ALA . . . -146.2 113.24 0.67 Allowed Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.946 -0.645 . . . . 0.0 111.978 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.517 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -32.71 121.13 0.34 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.741 0.305 . . . . 0.0 111.327 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.476 ' HB1' ' HB ' ' A' ' 16' ' ' ILE . . . -137.35 149.96 47.38 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -178.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.558 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.2 mp -98.14 124.31 51.14 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.306 0 CA-C-O 121.119 0.485 . . . . 0.0 110.408 179.189 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.502 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 14.7 t80 -115.85 130.6 56.9 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.069 179.617 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 58.27 33.71 23.4 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.824 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.1 mttm 75.64 1.34 3.57 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.084 -178.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.497 ' O ' HG22 ' A' ' 8' ' ' ILE . 31.3 t -100.8 149.76 6.04 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.728 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.558 ' HA ' HG13 ' A' ' 8' ' ' ILE . 66.7 p -88.25 145.94 25.6 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.548 -179.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.433 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -175.54 -179.24 45.95 Favored Glycine 0 N--CA 1.442 -0.93 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.668 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.517 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 8.0 mm -106.69 136.32 41.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 CA-C-O 120.792 0.329 . . . . 0.0 110.138 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.532 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.2 OUTLIER -106.63 117.81 53.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 178.939 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.466 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -124.18 125.5 44.55 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.239 0.542 . . . . 0.0 111.551 -178.076 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.474 ' CD1' HG23 ' A' ' 103' ' ' THR . 33.7 mt -94.55 139.97 17.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.809 -179.567 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -131.41 113.76 14.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.031 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -91.01 5.47 48.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.239 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -78.59 -17.96 55.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.937 0.399 . . . . 0.0 110.428 179.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.33 143.96 12.7 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.824 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.4 t -119.61 116.15 33.44 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.966 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.489 ' HG2' HG21 ' A' ' 41' ' ' VAL . 72.1 Cg_endo -77.39 148.41 87.08 Favored 'Cis proline' 0 C--N 1.348 0.544 0 C-N-CA 123.258 -1.559 . . . . 0.0 112.29 -0.098 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.56 139.37 7.02 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.793 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -130.66 166.98 19.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.192 0.52 . . . . 0.0 111.577 -179.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.8 tt -121.16 128.61 52.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.824 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.7 m -116.08 127.2 54.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.065 0.46 . . . . 0.0 111.821 -179.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.484 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 55.3 t90 -100.45 125.15 46.71 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.108 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 14.6 tpt180 -120.92 116.65 25.53 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.589 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 26.3 t -44.54 156.8 0.07 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.675 0.274 . . . . 0.0 110.879 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.433 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -65.94 -39.42 90.48 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 121.586 0.708 . . . . 0.0 109.305 179.866 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -88.16 -20.01 26.18 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.603 -1.18 . . . . 0.0 111.091 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.58 33.48 11.41 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.483 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -97.59 -22.31 16.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.704 0.288 . . . . 0.0 111.525 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.94 145.01 43.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.208 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 38.8 t -139.14 140.0 38.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.185 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.502 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 45.9 t60 -139.61 145.84 39.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.401 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 52.4 m -129.02 138.44 51.92 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.97 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 85.4 t -132.61 140.91 46.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 121.151 0.5 . . . . 0.0 111.846 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.489 HG21 ' HG2' ' A' ' 24' ' ' PRO . 2.1 p -87.42 118.12 32.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.166 178.027 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.434 ' HA ' HG12 ' A' ' 45' ' ' ILE . 84.3 mt -74.92 -31.77 61.63 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -178.305 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.444 ' CB ' ' HB2' ' A' ' 24' ' ' PRO . 3.2 t -53.74 -24.66 15.62 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.478 HG21 ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -92.0 -22.41 19.99 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.806 0.336 . . . . 0.0 111.13 -179.791 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.458 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 46.4 mm -56.2 91.91 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.11 0.481 . . . . 0.0 110.844 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -63.36 -29.55 70.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.394 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.627 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 0.3 OUTLIER -153.99 157.41 39.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.09 0.471 . . . . 0.0 111.587 -179.751 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -128.34 127.59 42.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.544 179.138 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -115.99 141.27 48.34 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.006 0.432 . . . . 0.0 111.548 -179.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -148.12 135.36 20.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.699 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 68.7 p -75.79 131.49 76.48 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.823 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -69.25 160.66 48.97 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.527 2.152 . . . . 0.0 112.404 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.9 -40.56 73.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.159 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 86.0 p -62.75 -26.79 68.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.816 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 41.2 t -75.74 121.7 22.92 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.92 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -56.25 -18.69 11.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.273 179.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.04 154.48 35.65 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.717 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.434 ' HE1' ' HA ' ' A' ' 92' ' ' ASN . 63.6 mtp -143.07 79.75 1.66 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.916 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.4 mpp? -155.24 169.1 24.97 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.049 0.452 . . . . 0.0 111.446 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.43 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.2 OUTLIER -132.36 124.24 28.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.989 179.33 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.6 mmt180 -107.83 121.95 45.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.954 0.407 . . . . 0.0 111.846 -179.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.434 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -102.7 134.8 45.49 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.141 178.968 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.627 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.3 mm -99.95 150.13 5.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.532 -0.303 . . . . 0.0 111.069 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -115.62 134.28 11.42 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.206 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 25.7 mttt -53.78 139.52 32.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.852 0.358 . . . . 0.0 111.066 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.455 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.4 p -113.3 -161.92 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.956 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.455 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 0.2 OUTLIER -176.97 67.79 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.141 179.923 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 50.8 mp0 -58.31 -20.87 46.46 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.426 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 27.0 t -58.97 -17.98 29.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.176 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 52.7 mmtt -62.41 -44.02 97.43 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.777 0.323 . . . . 0.0 111.142 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 60.38 92.99 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.774 -179.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 14.1 mtt-85 -106.55 150.6 25.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.989 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.9 mmtt -96.64 149.05 22.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.91 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -96.58 171.66 8.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.866 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -59.68 -20.19 54.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.283 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -86.76 5.96 33.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.389 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.12 15.92 81.06 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.573 -0.823 . . . . 0.0 112.638 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -111.91 145.26 39.85 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.9 0.381 . . . . 0.0 110.943 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -74.04 145.74 44.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.942 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.455 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.2 m -130.53 158.92 42.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.062 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 19.0 t -101.62 98.66 9.9 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.698 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.455 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 80.8 Cg_exo -44.59 145.41 2.69 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.369 2.046 . . . . 0.0 112.651 -179.083 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.447 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 13.1 mtmt -100.67 148.54 35.14 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.953 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 16.8 Cg_exo -72.41 150.52 52.34 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 123.425 2.75 . . . . 0.0 112.654 -178.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -70.89 153.93 42.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.839 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.6 mpp_? -156.5 119.99 4.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.844 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 62.1 m-70 -100.61 155.76 17.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.575 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 23.9 ttt -129.13 125.23 36.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.903 0.382 . . . . 0.0 111.249 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.502 ' CE2' ' CD1' ' A' ' 9' ' ' PHE . 91.9 m-85 -130.86 146.38 52.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.484 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 5.8 t -119.39 133.64 55.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.867 0.365 . . . . 0.0 110.983 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.444 ' CE2' ' HB1' ' A' ' 7' ' ' ALA . 2.5 m-85 -125.96 136.35 52.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.82 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.434 ' HA ' ' HE1' ' A' ' 58' ' ' MET . 34.2 m-20 -97.1 22.2 8.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.791 0.329 . . . . 0.0 111.076 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -144.99 107.28 4.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.573 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -52.83 -28.82 24.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.071 0.463 . . . . 0.0 111.055 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -77.16 -54.9 5.93 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.303 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 53.4 t -53.87 -46.97 64.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.856 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.66 -35.6 80.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.29 179.514 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -65.86 -32.79 74.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.559 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -66.71 -41.05 88.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.117 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.408 ' CD1' HG21 ' A' ' 16' ' ' ILE . 22.6 mm -66.29 -48.75 80.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.518 179.44 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.56 -27.63 67.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.57 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 40.6 mtm -78.48 -39.08 39.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.616 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.474 HG23 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -80.62 -32.03 36.44 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.658 179.841 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 13.6 mt -65.99 -39.33 90.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.621 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -62.71 -26.83 68.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.883 179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -70.33 -43.73 69.69 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.951 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.459 ' O ' ' HB2' ' A' ' 110' ' ' ARG . 4.1 mt -61.86 -47.02 95.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.327 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.441 ' H ' HG13 ' A' ' 108' ' ' ILE . 2.6 mt -57.43 -60.03 2.58 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.572 0 CA-C-O 121.838 0.828 . . . . 0.0 109.347 179.181 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.1 m -48.78 -28.92 3.99 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.088 -1.414 . . . . 0.0 111.266 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.459 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 35.3 mtt-85 -69.26 -32.54 71.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.044 0.45 . . . . 0.0 110.809 179.686 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -90.01 -28.8 18.85 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.926 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.336 0 CA-C-O 120.881 0.372 . . . . 0.0 110.543 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.2 t . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.851 0.358 . . . . 0.0 111.049 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 61.4 m80 64.42 32.5 11.89 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.172 0.511 . . . . 0.0 110.989 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.55 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 77.4 p 177.6 161.73 0.52 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.594 179.237 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 162.78 116.19 0.37 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.296 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.597 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -46.64 103.6 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.192 0.52 . . . . 0.0 111.431 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.465 ' O ' ' O ' ' A' ' 14' ' ' GLY . . . -118.87 152.23 36.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.769 -178.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.544 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.0 OUTLIER -99.55 125.25 53.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.072 0.463 . . . . 0.0 110.419 179.009 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.507 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 10.0 t80 -113.34 130.12 56.36 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.132 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 82.5 mt-10 56.85 34.77 25.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.933 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.2 mttm 76.02 1.2 3.44 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.406 -179.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.528 ' O ' HG22 ' A' ' 8' ' ' ILE . 41.5 t -100.31 156.18 4.19 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.617 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.544 ' HA ' HG13 ' A' ' 8' ' ' ILE . 94.1 p -98.19 149.0 23.02 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 121.427 0.632 . . . . 0.0 112.588 -178.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.465 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 175.16 -179.74 46.24 Favored Glycine 0 N--CA 1.449 -0.493 0 CA-C-N 114.653 -1.158 . . . . 0.0 110.313 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.597 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.59 141.54 21.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 117.615 0.707 . . . . 0.0 110.406 179.344 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.55 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -106.63 118.45 54.37 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.737 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 179.565 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.466 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -120.99 131.19 54.15 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.17 0.51 . . . . 0.0 111.546 -178.467 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.424 ' CD1' HG22 ' A' ' 103' ' ' THR . 90.3 mt -106.08 138.57 30.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.056 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -131.32 117.18 18.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.149 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -93.63 4.93 53.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.189 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -79.12 -17.59 54.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.959 0.409 . . . . 0.0 110.318 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.22 141.22 17.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.873 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.42 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.0 t -114.28 116.33 44.33 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.825 179.893 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.42 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 1.2 Cg_endo -81.43 142.95 56.86 Favored 'Cis proline' 0 C--N 1.349 0.589 0 C-N-CA 123.807 -1.33 . . . . 0.0 111.934 0.102 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -45.33 141.64 2.47 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.142 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -136.59 167.15 21.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.158 0.504 . . . . 0.0 111.626 -179.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.1 tt -121.19 129.2 53.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.818 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.7 m -117.43 126.21 52.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.159 0.504 . . . . 0.0 112.177 -178.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.466 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 59.8 t90 -100.51 128.88 46.44 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.937 179.008 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 26.3 ttt180 -124.58 116.78 22.99 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.81 0.338 . . . . 0.0 111.069 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.434 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 16.3 m -46.11 168.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.125 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -42.07 61.72 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 121.48 0.657 . . . . 0.0 109.555 179.526 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -85.22 -20.19 30.52 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.832 -1.076 . . . . 0.0 111.03 179.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.01 33.26 11.09 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.513 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 51.9 t0 -100.55 -23.1 14.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.655 0.264 . . . . 0.0 111.425 -179.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.88 135.67 48.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.995 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 12.7 p -139.12 130.32 34.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.143 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.507 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 51.3 t60 -129.43 145.79 51.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.022 0.439 . . . . 0.0 111.291 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 46.1 m -129.07 135.05 48.39 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.965 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 98.7 t -126.26 140.87 47.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.161 0.505 . . . . 0.0 111.513 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.469 ' CG1' HG21 ' A' ' 44' ' ' THR . 2.1 p -85.51 117.55 30.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.409 ' HA ' HG12 ' A' ' 45' ' ' ILE . 72.5 mt -75.37 -29.66 59.96 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.995 -178.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.403 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 9.7 t -56.14 -21.71 24.22 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.225 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.469 HG21 ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -96.8 -21.89 17.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.699 0.285 . . . . 0.0 111.186 -179.794 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.409 HG12 ' HA ' ' A' ' 42' ' ' LEU . 38.0 mm -56.64 90.59 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.049 0.452 . . . . 0.0 110.89 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -71.06 -27.25 63.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.604 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.707 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 20.7 mttm -144.74 152.39 40.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.013 0.435 . . . . 0.0 111.629 -179.399 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.405 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -132.69 131.13 40.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.988 179.345 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -125.9 143.78 50.94 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.95 -179.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.26 145.94 31.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.979 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 42.5 p -75.7 128.26 84.06 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.505 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -61.41 154.16 60.91 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.573 2.182 . . . . 0.0 112.467 -179.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.87 -40.51 97.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.173 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 85.3 p -59.44 -26.8 65.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.859 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 29.5 m -86.32 117.37 25.08 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.843 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -56.38 -18.65 11.67 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.596 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.8 mmtm -71.83 124.0 23.88 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.029 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 27.3 mmm -104.15 118.9 37.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.498 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.4 ttm -175.75 161.62 2.58 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.176 0.512 . . . . 0.0 112.006 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.4 tt -153.59 123.94 7.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.756 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 29.8 ttp180 -117.94 138.03 52.44 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.432 ' N ' ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -112.44 136.17 52.26 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.259 179.291 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.707 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.3 mm -103.29 133.79 46.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.816 0.341 . . . . 0.0 111.142 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -101.93 134.07 11.61 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.076 179.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 40.1 mttt -44.1 137.5 3.35 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.942 0.401 . . . . 0.0 111.286 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.452 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.2 p -105.2 -162.13 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.009 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.452 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 52.1 t0 -173.55 68.99 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.261 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -56.0 -22.21 25.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.398 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.4 m -58.2 -18.87 29.04 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.907 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.7 mtmt -69.57 -42.62 74.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.981 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.7 mttt 60.26 92.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.866 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -92.03 137.9 31.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.873 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 28.8 mmtm -89.16 145.29 25.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.897 0.38 . . . . 0.0 110.893 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -93.29 171.95 8.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.883 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 40.7 t-20 -59.43 -20.53 55.74 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.301 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 50.7 mp0 -86.41 3.44 43.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.359 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.07 14.29 82.05 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.709 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -110.08 144.43 38.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.909 0.385 . . . . 0.0 110.969 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -70.73 147.26 49.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.094 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.424 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.8 m -140.48 158.65 24.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.028 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 20.3 t -83.64 110.19 23.23 Favored Pre-proline 0 C--N 1.326 -0.444 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.424 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 86.1 Cg_exo -46.2 145.26 5.7 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.196 1.931 . . . . 0.0 112.622 -178.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.505 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 8.5 mmtm -83.09 99.3 0.64 Allowed Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.126 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.505 ' HD2' ' HA ' ' A' ' 83' ' ' LYS . 1.3 Cg_endo -40.77 149.61 0.16 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 123.433 2.755 . . . . 0.0 112.598 179.165 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -65.38 139.64 58.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.776 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 12.0 mtp180 -150.5 120.02 6.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.868 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -103.48 143.49 32.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.579 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 23.7 ttt -118.55 131.91 56.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.231 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.501 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 94.1 m-85 -139.2 144.39 38.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.645 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 1.5 m -125.17 135.1 52.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.074 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.476 ' CD1' ' N ' ' A' ' 91' ' ' PHE . 2.1 m-85 -123.22 172.5 8.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.532 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 69.9 m-20 -126.74 26.9 6.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.005 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -157.3 121.77 4.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.607 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 32.9 mmt-85 -56.1 -36.18 67.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.026 0.441 . . . . 0.0 110.76 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.14 -55.17 15.32 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.919 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 55.3 t -61.13 -40.75 86.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.105 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.435 ' HG3' ' CD1' ' A' ' 91' ' ' PHE . 0.0 OUTLIER -69.31 -34.78 75.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.312 179.628 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.445 ' O ' ' HG2' ' A' ' 101' ' ' LYS . 67.3 m-20 -76.14 -31.02 58.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.08 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -62.23 -36.27 81.46 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.313 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.464 HG13 ' CE2' ' A' ' 91' ' ' PHE . 22.1 mm -70.57 -49.15 54.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.957 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.445 ' HG2' ' O ' ' A' ' 98' ' ' ASP . 4.4 pttt -64.8 -27.51 68.93 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.923 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.442 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.1 OUTLIER -78.55 -41.91 30.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.109 179.564 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.424 HG22 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -71.4 -41.4 69.66 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.641 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 13.9 mt -60.31 -41.1 92.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.801 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -61.87 -30.23 70.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.939 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -68.48 -36.27 78.7 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.118 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.464 ' CG2' ' CE2' ' A' ' 111' ' ' TYR . 6.6 mt -70.72 -46.65 68.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.476 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.423 ' CG2' ' CD ' ' A' ' 112' ' ' LYS . 2.5 mt -57.48 -61.09 1.42 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 CA-C-O 121.803 0.811 . . . . 0.0 109.385 179.157 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.4 p -50.28 -31.71 14.98 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.199 -1.364 . . . . 0.0 110.91 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 52.5 mtt-85 -68.63 -33.53 74.17 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.832 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.464 ' CE2' ' CG2' ' A' ' 107' ' ' ILE . 20.1 m-85 -92.19 -33.92 14.51 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.921 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.423 ' CD ' ' CG2' ' A' ' 108' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.788 179.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.0 m . . . . . 0 C--O 1.23 0.031 0 CA-C-O 120.854 0.359 . . . . 0.0 110.951 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 64.2 m80 -126.43 33.27 5.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.15 0.5 . . . . 0.0 110.924 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.533 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 62.9 p 179.14 115.73 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.889 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.425 ' O ' ' C ' ' A' ' 6' ' ' ALA . . . -146.64 113.45 0.67 Allowed Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.929 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.522 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -32.93 120.09 0.34 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.769 0.319 . . . . 0.0 111.269 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.444 ' O ' ' O ' ' A' ' 14' ' ' GLY . . . -136.28 151.32 49.52 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -178.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.561 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.2 mp -98.54 125.36 51.92 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.27 0 CA-C-O 121.063 0.458 . . . . 0.0 110.523 179.29 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.504 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 7.4 t80 -117.05 130.13 56.47 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.015 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 58.58 33.81 23.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.814 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 69.8 mttt 75.46 1.6 3.66 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.149 -178.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.479 ' O ' HG23 ' A' ' 8' ' ' ILE . 31.3 t -101.44 148.4 7.34 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.745 0 CA-C-N 116.031 -0.532 . . . . 0.0 109.63 179.055 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.561 ' HA ' HG13 ' A' ' 8' ' ' ILE . 78.7 p -86.83 146.21 26.3 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-O 121.446 0.641 . . . . 0.0 111.523 -179.368 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.444 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . -175.6 -179.1 45.92 Favored Glycine 0 N--CA 1.441 -0.984 0 CA-C-N 115.056 -0.975 . . . . 0.0 111.764 -179.528 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.522 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 7.0 mm -106.21 136.01 42.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 120.849 0.357 . . . . 0.0 110.062 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.533 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.2 OUTLIER -106.6 117.85 53.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.836 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.453 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -123.61 132.13 53.79 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.337 0.589 . . . . 0.0 111.596 -178.049 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.449 ' CD1' HG23 ' A' ' 103' ' ' THR . 46.1 mt -102.46 133.0 47.36 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.058 -179.409 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -124.35 114.18 19.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.012 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -88.35 5.61 41.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.251 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -78.37 -18.23 55.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.911 0.386 . . . . 0.0 110.358 179.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -98.07 145.43 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.904 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 t -121.81 116.25 30.37 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.991 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.445 ' HG2' HG21 ' A' ' 41' ' ' VAL . 72.1 Cg_endo -76.22 149.79 92.35 Favored 'Cis proline' 0 C--N 1.35 0.612 0 C-N-CA 123.211 -1.579 . . . . 0.0 112.108 -0.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.14 137.56 5.96 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.801 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -128.35 164.18 23.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.148 0.499 . . . . 0.0 111.803 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.8 tt -121.12 129.19 53.18 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.696 179.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.0 m -116.5 129.0 55.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.137 0.494 . . . . 0.0 111.902 -179.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.483 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 57.8 t90 -100.37 125.68 46.66 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.139 179.083 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.19 116.51 23.52 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.638 179.731 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 11.2 m -44.42 158.36 0.05 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.704 0.288 . . . . 0.0 110.975 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.411 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -66.34 -39.45 89.22 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.494 0.664 . . . . 0.0 109.263 179.974 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 48.0 p30 -85.51 -20.8 29.13 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.213 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.77 32.71 12.4 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.649 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -99.5 -23.56 15.06 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.839 0.352 . . . . 0.0 111.467 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.3 mtmt -130.12 142.42 50.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.07 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 14.4 p -139.04 136.71 42.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.22 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.504 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 82.0 t60 -136.39 146.34 46.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.007 0.432 . . . . 0.0 111.347 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 43.5 m -127.47 136.95 52.5 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.951 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 92.6 t -132.38 140.87 46.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-O 121.018 0.437 . . . . 0.0 111.599 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.485 ' CG1' ' CG2' ' A' ' 44' ' ' THR . 0.8 OUTLIER -87.75 118.15 32.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 178.026 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.453 ' HA ' HG12 ' A' ' 45' ' ' ILE . 46.6 mt -71.61 -29.7 64.97 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -178.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.417 ' CB ' ' HB2' ' A' ' 24' ' ' PRO . 1.5 t -55.51 -22.22 20.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.671 0.272 . . . . 0.0 111.684 -179.39 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.485 ' CG2' ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -88.69 -24.96 22.6 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.786 0.327 . . . . 0.0 111.252 -179.653 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.453 HG12 ' HA ' ' A' ' 42' ' ' LEU . 50.5 mm -56.04 91.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.064 0.459 . . . . 0.0 111.021 -179.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 63' ' ' ILE . 7.1 t0 -78.59 -25.82 45.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.598 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 7.2 mmmt -148.32 148.59 30.58 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.053 0.454 . . . . 0.0 111.518 -179.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 41.2 mt -115.68 124.37 50.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.498 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -115.15 137.84 51.57 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.76 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.89 151.27 37.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.014 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 55.1 p -75.72 130.31 79.3 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.58 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.32 158.46 44.64 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.583 2.189 . . . . 0.0 112.489 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.59 -43.0 97.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.066 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.1 m -59.35 -27.59 66.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.072 0.463 . . . . 0.0 110.822 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 31.5 t -82.31 119.55 24.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.896 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -57.18 -18.27 14.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.44 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 35.8 mmtm -60.45 155.85 17.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.854 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.423 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 17.3 mtp -143.02 79.9 1.66 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.794 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -147.55 167.22 25.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.061 0.458 . . . . 0.0 111.63 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.2 tp -136.46 128.66 29.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.034 179.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -114.26 122.03 45.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.945 0.402 . . . . 0.0 111.788 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.451 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.3 OUTLIER -97.24 139.6 32.97 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.924 179.014 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.456 ' O ' ' N ' ' A' ' 46' ' ' ASP . 0.9 OUTLIER -115.66 119.22 61.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.017 -179.686 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -89.49 151.77 22.13 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.248 179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.8 mttm -59.06 135.51 57.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.805 0.336 . . . . 0.0 110.762 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.456 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.3 p -79.62 -167.55 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.169 0.509 . . . . 0.0 111.193 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.456 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 54.2 p-10 -148.44 59.51 1.08 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.638 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -56.01 -22.55 27.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.387 -179.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.4 t -59.62 -17.52 34.07 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.015 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.8 mmtp -71.01 -50.68 31.51 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.761 0.315 . . . . 0.0 111.092 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.4 mmtm 63.43 95.22 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.712 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 31.6 mmt180 -99.65 168.64 9.8 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.804 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.9 mttt -124.91 146.69 49.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.96 0.409 . . . . 0.0 111.08 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -86.28 171.93 10.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.8 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -62.15 -18.11 59.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.343 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -85.95 4.38 37.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.569 0.223 . . . . 0.0 111.425 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 83.54 3.22 89.87 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.78 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -91.26 168.14 11.81 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.738 0.304 . . . . 0.0 110.763 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -94.89 153.38 17.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.851 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.413 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.2 m -138.18 158.9 32.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.969 0.414 . . . . 0.0 111.222 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 38.5 t -101.93 98.74 10.52 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.563 178.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.413 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 93.5 Cg_exo -42.81 145.34 1.12 Allowed 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.537 2.158 . . . . 0.0 112.779 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.448 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 11.4 mttp -84.35 148.58 53.01 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.054 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 16.4 Cg_exo -73.06 162.4 40.96 Favored 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 123.509 2.806 . . . . 0.0 112.741 -178.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -65.45 144.03 57.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.802 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 32.9 mtp180 -145.12 119.92 9.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.935 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 58.2 m-70 -107.4 159.11 16.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.61 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.1 ttt -130.44 132.03 45.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.029 0.442 . . . . 0.0 111.345 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.491 ' CE2' ' CD1' ' A' ' 9' ' ' PHE . 87.6 m-85 -138.62 145.99 41.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.459 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -118.96 133.87 55.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.809 0.338 . . . . 0.0 111.1 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.502 ' CD1' ' N ' ' A' ' 91' ' ' PHE . 1.4 m-85 -127.5 158.24 37.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.573 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.423 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 53.5 m-20 -115.79 25.53 10.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.936 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 -156.68 108.03 2.42 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.487 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 8.9 tpp180 -46.86 -29.87 2.21 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.005 0.431 . . . . 0.0 111.288 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.2 -54.0 9.54 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.537 -179.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 58.1 t -53.63 -49.66 54.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.827 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.415 ' HB3' ' CG ' ' A' ' 91' ' ' PHE . 18.7 ptm -63.98 -37.22 86.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.0 0.429 . . . . 0.0 110.064 179.386 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -66.38 -31.2 71.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.511 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -67.89 -40.46 83.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.931 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.412 ' CD1' HG23 ' A' ' 16' ' ' ILE . 24.7 mm -66.43 -49.77 72.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.423 179.273 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 3.9 pttt -66.01 -27.28 68.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.46 179.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 64.6 mtp -78.25 -40.19 37.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.542 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.449 HG23 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -79.11 -37.18 39.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.514 179.735 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 12.0 mt -61.59 -39.56 91.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.767 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.65 -29.1 69.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.878 179.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 99.6 mm-40 -69.23 -33.8 73.83 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.811 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.441 ' CG2' ' CE2' ' A' ' 111' ' ' TYR . 4.0 mt -72.52 -44.48 61.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.308 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.439 ' CG2' ' CD ' ' A' ' 112' ' ' LYS . 2.6 mt -58.84 -61.18 1.52 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.551 0 CA-C-O 121.764 0.792 . . . . 0.0 109.474 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.1 t -50.91 -28.84 10.51 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.16 -1.382 . . . . 0.0 110.943 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 49.3 mtt180 -70.32 -33.7 71.82 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.762 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.441 ' CE2' ' CG2' ' A' ' 107' ' ' ILE . 19.9 m-85 -92.32 -35.33 13.8 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.938 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.439 ' CD ' ' CG2' ' A' ' 108' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.741 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.2 t . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.664 0.269 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.436 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 55.1 m80 -117.37 37.9 3.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.982 0.42 . . . . 0.0 111.265 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 1.2 m -166.68 176.62 7.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.671 179.258 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 159.08 126.09 0.84 Allowed Glycine 0 N--CA 1.444 -0.814 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.321 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.567 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -53.65 111.65 0.77 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.018 0.437 . . . . 0.0 111.192 -179.689 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.442 ' O ' ' O ' ' A' ' 14' ' ' GLY . . . -125.81 150.27 47.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.831 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.525 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -100.14 125.78 53.8 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.267 0 CA-C-O 120.979 0.418 . . . . 0.0 110.222 179.049 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.507 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 6.1 t80 -112.93 131.16 55.85 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.284 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.0 mt-10 55.07 34.25 22.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.859 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.0 mttp 76.44 0.8 3.26 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.365 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.521 ' O ' HG21 ' A' ' 8' ' ' ILE . 40.4 t -98.78 154.25 4.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 178.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.525 ' HA ' HG13 ' A' ' 8' ' ' ILE . 83.6 p -96.32 149.0 22.17 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 121.721 0.772 . . . . 0.0 112.742 -178.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.442 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 175.7 -179.69 46.72 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 114.449 -1.25 . . . . 0.0 110.292 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.567 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.71 144.35 15.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 117.673 0.736 . . . . 0.0 110.529 179.36 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.461 HG22 HD11 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -106.81 118.55 54.77 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 CA-C-N 115.358 -0.837 . . . . 0.0 108.835 179.577 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.5 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -121.14 132.31 54.78 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.355 -178.689 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.44 ' CD1' HG23 ' A' ' 103' ' ' THR . 59.3 mt -104.08 140.1 23.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.074 -179.163 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -132.51 111.46 11.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.862 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -90.36 5.2 48.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.325 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -78.9 -17.76 55.02 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.954 0.406 . . . . 0.0 110.36 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.62 142.97 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.947 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.5 t -115.81 116.77 40.47 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.834 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -80.08 144.65 69.92 Favored 'Cis proline' 0 C--N 1.348 0.534 0 C-N-CA 123.707 -1.372 . . . . 0.0 111.933 0.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.78 139.58 5.25 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.886 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -133.49 167.27 20.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.088 0.47 . . . . 0.0 111.661 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.6 tt -120.97 128.78 53.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.639 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.3 m -114.74 127.48 55.77 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.208 0.528 . . . . 0.0 112.085 -178.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.478 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 56.3 t90 -100.43 128.8 46.39 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.8 179.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 14.6 tpt180 -123.51 116.04 22.52 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.79 0.329 . . . . 0.0 110.976 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.425 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 30.9 t -45.37 164.36 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.062 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.41 -41.56 66.12 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.482 0.658 . . . . 0.0 109.507 179.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -82.32 -22.17 35.72 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.792 -1.094 . . . . 0.0 111.027 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.72 32.99 10.42 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.458 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -106.82 -20.18 13.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.712 0.291 . . . . 0.0 111.433 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.46 135.0 48.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.799 0.333 . . . . 0.0 111.109 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 13.2 p -139.15 138.93 40.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.042 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.507 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 77.5 t60 -136.81 146.24 45.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.082 0.468 . . . . 0.0 111.364 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 48.2 m -127.15 132.77 50.46 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.073 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 95.7 t -124.32 140.87 46.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.457 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.468 ' CG1' HG22 ' A' ' 44' ' ' THR . 2.1 p -85.2 117.33 30.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 178.1 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.457 ' HA ' HG12 ' A' ' 45' ' ' ILE . 68.5 mt -75.7 -30.42 59.33 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.124 -178.538 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 60.5 p -56.12 -21.74 24.2 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -179.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.468 HG22 ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -93.91 -24.73 17.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.742 0.306 . . . . 0.0 111.287 -179.704 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.457 HG12 ' HA ' ' A' ' 42' ' ' LEU . 42.7 mm -51.17 93.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.983 0.421 . . . . 0.0 110.918 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -77.54 -27.68 51.7 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.511 -179.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.525 ' HG2' HD12 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -140.3 159.15 42.83 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 121.201 0.524 . . . . 0.0 111.381 -179.298 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 27.4 mt -126.89 124.24 39.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.953 178.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.4 ' O ' ' N ' ' A' ' 61' ' ' ARG . 79.9 mt-30 -120.81 136.9 54.78 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.977 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -148.23 151.23 35.12 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.115 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 60.5 p -75.56 126.82 87.01 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.44 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -59.51 155.85 39.61 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.55 2.167 . . . . 0.0 112.515 -179.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.48 -43.08 97.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.091 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 93.6 p -59.59 -27.62 66.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.038 0.447 . . . . 0.0 110.722 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 26.3 t -80.62 120.9 25.16 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.954 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -56.65 -18.48 12.35 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.334 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 30.4 mmtt -66.79 156.49 35.38 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.872 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.446 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 31.7 mtp -143.0 89.89 2.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.743 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.453 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 44.3 mtm -155.74 156.36 34.72 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.052 0.453 . . . . 0.0 111.817 -179.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.425 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -131.61 123.9 28.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.38 179.707 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.401 ' NH2' ' NE ' ' A' ' 86' ' ' ARG . 39.0 mtp180 -107.82 127.08 53.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.847 0.355 . . . . 0.0 111.333 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.481 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -111.04 123.45 50.22 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.943 -179.929 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.536 ' CG1' ' HG2' ' A' ' 86' ' ' ARG . 3.9 mp -109.64 136.04 46.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.831 0.348 . . . . 0.0 111.136 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.9 -169.42 38.21 Favored Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.378 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.91 143.43 34.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.759 0.314 . . . . 0.0 110.807 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.456 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.3 p -99.97 -162.25 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.045 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.456 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 14.3 t70 -175.14 70.97 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.254 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 -56.9 -20.61 24.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.492 -179.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 27.1 t -57.51 -18.59 19.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.206 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.3 mmmt -57.76 -46.77 84.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.068 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? 62.29 94.32 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.856 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 57.7 mmm-85 -107.64 154.92 20.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.822 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -119.11 145.33 46.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.908 0.385 . . . . 0.0 111.041 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -84.85 171.27 12.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.865 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -61.97 -18.09 59.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.384 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -85.41 4.67 34.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.551 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 81.61 6.57 89.02 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.722 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -94.23 162.07 14.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.707 0.289 . . . . 0.0 110.681 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -94.97 151.83 18.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.938 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.436 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.3 m -135.41 158.93 40.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.15 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 19.4 t -101.05 98.73 9.13 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.708 178.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.436 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 92.1 Cg_exo -42.81 145.52 1.07 Allowed 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.562 2.175 . . . . 0.0 112.845 -179.005 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -104.48 150.84 38.93 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.715 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -72.43 147.14 46.09 Favored 'Trans proline' 0 N--CA 1.464 -0.207 0 C-N-CA 123.524 2.816 . . . . 0.0 112.699 -178.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -65.63 133.73 51.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.905 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.536 ' HG2' ' CG1' ' A' ' 63' ' ' ILE . 10.4 mtm180 -123.94 124.43 42.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.767 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -93.49 159.15 15.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.554 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 25.4 ttt -133.45 128.99 36.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.87 0.367 . . . . 0.0 111.381 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.445 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 97.9 m-85 -139.68 148.99 43.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.603 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.453 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 2.8 t -125.64 124.17 40.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.841 0.353 . . . . 0.0 110.937 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.425 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 3.8 m-85 -112.44 170.61 8.05 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.914 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.446 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 27.7 p30 -128.76 26.09 5.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.146 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -153.53 112.05 3.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.65 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.71 -33.0 63.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.208 0.528 . . . . 0.0 110.902 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.19 -49.64 54.81 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.162 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 47.9 t -58.89 -40.64 80.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.556 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -63.48 -33.56 75.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.431 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -65.44 -35.4 80.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.741 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -69.28 -41.19 77.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.806 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.418 HD12 ' CG2' ' A' ' 16' ' ' ILE . 21.5 mm -62.76 -52.02 64.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.738 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 5.6 mtpp -64.55 -27.87 69.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.723 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 36.3 mtm -78.42 -36.88 45.06 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.062 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.44 HG23 ' CD1' ' A' ' 18' ' ' ILE . 0.5 OUTLIER -82.06 -38.96 24.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.009 -179.792 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 16.2 mt -64.08 -39.67 94.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.841 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -64.46 -29.34 70.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.865 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -69.37 -31.64 70.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.921 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.412 ' CD1' ' CD1' ' A' ' 42' ' ' LEU . 5.9 mt -74.89 -46.43 40.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.282 -179.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.437 ' H ' HG13 ' A' ' 108' ' ' ILE . 2.2 mt -58.22 -61.24 1.44 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.589 0 CA-C-O 121.689 0.757 . . . . 0.0 109.343 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.5 m -50.53 -28.91 9.39 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.325 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.92 -41.56 97.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.449 179.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 75.5 m-85 -83.64 -29.65 27.51 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.344 179.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 18.9 mttt . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.502 179.455 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.0 t . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.862 0.363 . . . . 0.0 110.932 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 52.8 m80 62.19 32.6 17.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.218 0.533 . . . . 0.0 110.876 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.585 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 75.1 p 178.11 162.41 0.63 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.572 179.177 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.401 ' CA ' ' CG1' ' A' ' 96' ' ' VAL . . . 161.6 116.27 0.39 Allowed Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.716 -0.755 . . . . 0.0 112.535 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.586 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -46.88 102.87 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.104 0.478 . . . . 0.0 111.298 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.48 ' CB ' ' CE2' ' A' ' 91' ' ' PHE . . . -117.64 151.79 36.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.931 -178.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.532 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.9 OUTLIER -98.78 123.88 51.65 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.26 0 CA-C-O 121.101 0.477 . . . . 0.0 110.373 178.918 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.504 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 14.3 t80 -112.26 130.17 56.02 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.045 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 56.52 34.35 24.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.731 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.8 mtpm? 75.88 1.7 3.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.287 -179.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.513 ' O ' HG21 ' A' ' 8' ' ' ILE . 40.8 t -100.8 154.57 4.56 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.596 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.001 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.532 ' HA ' HG13 ' A' ' 8' ' ' ILE . 89.5 p -95.66 149.42 21.48 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 121.549 0.69 . . . . 0.0 112.646 -178.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.445 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 174.54 -179.73 45.68 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 114.645 -1.161 . . . . 0.0 110.41 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.586 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.83 141.91 20.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 117.795 0.797 . . . . 0.0 110.579 179.426 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.585 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -106.77 118.48 54.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 179.62 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.475 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -121.83 130.44 53.39 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.525 -178.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.435 ' CD1' HG21 ' A' ' 103' ' ' THR . 77.2 mt -101.45 129.7 52.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.12 -179.526 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 51.6 t30 -116.1 111.44 20.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.034 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -89.75 7.03 38.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.165 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -78.94 -18.47 53.74 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.852 0.358 . . . . 0.0 110.384 179.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.502 ' CG2' ' N ' ' A' ' 23' ' ' SER . 0.5 OUTLIER -100.19 159.77 3.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.892 -179.961 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.502 ' N ' ' CG2' ' A' ' 22' ' ' VAL . 2.0 t -131.04 117.11 16.98 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.04 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -77.12 147.48 85.89 Favored 'Cis proline' 0 C--N 1.349 0.581 0 C-N-CA 123.36 -1.517 . . . . 0.0 112.188 0.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.22 136.51 9.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.727 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -128.07 166.89 17.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.222 0.534 . . . . 0.0 111.673 -179.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.0 tt -121.27 132.97 55.12 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.852 179.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 49.8 m -119.68 126.95 52.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.155 0.502 . . . . 0.0 112.031 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.466 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 57.9 t90 -100.58 130.31 46.62 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.884 179.116 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 24.4 tpt85 -125.25 114.99 19.67 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.837 0.351 . . . . 0.0 110.725 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.426 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 72.5 p -45.47 165.37 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.06 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.59 -42.35 58.87 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.481 0.658 . . . . 0.0 109.795 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -78.55 -22.74 46.78 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.101 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.52 33.44 10.27 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.381 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -111.36 -18.67 12.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.56 0.219 . . . . 0.0 111.588 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.3 mtmt -128.65 134.57 48.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.909 0.385 . . . . 0.0 111.187 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 11.0 p -139.26 141.83 34.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.038 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.504 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 71.0 t60 -137.6 146.1 43.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.125 0.488 . . . . 0.0 111.286 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 37.2 m -127.74 135.11 49.7 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.97 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.6 t -130.72 140.86 47.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 121.008 0.432 . . . . 0.0 111.548 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.521 ' CG1' ' CG2' ' A' ' 44' ' ' THR . 1.3 p -86.37 118.11 32.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.178 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.477 ' HA ' HG12 ' A' ' 45' ' ' ILE . 63.9 mt -70.89 -31.2 67.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.239 -0.437 . . . . 0.0 112.159 -178.34 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 2.0 t -52.67 -23.79 7.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.759 0.314 . . . . 0.0 111.543 -179.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.521 ' CG2' ' CG1' ' A' ' 41' ' ' VAL . 0.2 OUTLIER -86.25 -25.94 25.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.092 -179.866 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.477 HG12 ' HA ' ' A' ' 42' ' ' LEU . 41.6 mm -49.62 98.8 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.045 0.45 . . . . 0.0 111.116 -179.627 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -94.22 -21.01 19.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.583 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 61.2 mttm -156.61 137.68 13.61 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.976 0.417 . . . . 0.0 111.362 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 60.0 mt -109.37 124.26 50.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.595 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -109.66 130.93 55.47 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.55 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -141.87 140.79 32.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.192 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 71.3 p -75.7 124.0 88.59 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.523 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -61.51 160.31 28.43 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.578 2.185 . . . . 0.0 112.598 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.58 -42.97 97.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.095 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 86.2 p -60.26 -27.66 67.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.041 0.448 . . . . 0.0 110.603 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 28.7 t -81.22 119.9 24.2 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.806 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.1 tp10 -55.88 -18.86 9.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.386 179.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.1 mmtt -60.42 151.62 27.65 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.895 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.449 ' HE3' ' HA ' ' A' ' 92' ' ' ASN . 45.6 mtp -143.14 89.46 2.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.606 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 3.0 tmm? -172.85 147.22 1.67 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.001 0.429 . . . . 0.0 111.469 -179.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.39 134.53 54.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.309 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -120.82 124.22 44.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.036 0.446 . . . . 0.0 111.742 -179.519 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.436 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.4 OUTLIER -94.89 144.14 25.9 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.433 179.386 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 1.2 mm -118.27 124.01 72.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.019 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -92.17 154.53 22.42 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.534 -0.841 . . . . 0.0 112.367 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 37.3 mttt -67.75 155.56 39.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.837 0.351 . . . . 0.0 110.851 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.443 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.3 p -121.16 -162.31 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.996 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.443 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 40.6 t0 -177.67 71.11 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.234 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 82.0 mt-10 -55.13 -23.38 20.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.341 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.9 m -62.93 -15.04 53.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.935 179.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.3 mmtt -66.81 -43.86 82.75 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.709 0.29 . . . . 0.0 111.038 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.4 mptt 60.67 93.09 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.781 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.47 137.91 41.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.87 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.9 mmtp -83.7 145.33 28.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.088 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -88.02 176.82 7.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.975 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -67.01 -15.99 64.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.404 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -88.38 -7.9 55.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.242 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 94.37 9.27 59.25 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.626 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -103.29 145.7 29.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.791 0.329 . . . . 0.0 110.864 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -78.4 140.87 38.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.963 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.436 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 1.3 m -140.56 152.63 21.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.191 0.52 . . . . 0.0 111.387 -179.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.3 p -85.29 109.03 18.17 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.554 178.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.436 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 52.2 Cg_exo -53.22 145.55 43.4 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.128 1.885 . . . . 0.0 112.483 -178.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.421 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 2.9 mmpt? -89.97 154.52 47.52 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.997 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 19.2 Cg_exo -71.48 144.26 44.76 Favored 'Trans proline' 0 N--CA 1.465 -0.189 0 C-N-CA 123.514 2.81 . . . . 0.0 112.685 -178.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -66.43 141.93 57.76 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.97 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.9 mtm180 -144.78 120.0 10.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.651 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.405 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 68.3 m-70 -109.55 159.05 17.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.538 179.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 13.7 ttt -133.62 139.96 46.82 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.076 0.465 . . . . 0.0 111.401 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.496 ' CE2' ' CD1' ' A' ' 9' ' ' PHE . 91.7 m-85 -148.71 125.35 11.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.146 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 27.0 t -101.63 134.52 44.64 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.967 0.413 . . . . 0.0 111.542 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.48 ' CE2' ' CB ' ' A' ' 7' ' ' ALA . 2.2 m-85 -123.37 130.3 52.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.583 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.449 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 12.9 m120 -74.3 -18.57 60.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.353 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 -114.51 114.36 25.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.827 0.346 . . . . 0.0 110.825 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.94 -26.64 26.46 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.057 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.14 -46.04 62.34 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.255 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.401 ' CG1' ' CA ' ' A' ' 5' ' ' GLY . 61.4 t -58.49 -52.36 60.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.622 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.451 ' HB3' ' CG ' ' A' ' 91' ' ' PHE . 9.8 ptm -60.24 -32.35 71.06 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 47.3 t0 -61.55 -35.02 76.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.388 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.401 ' O ' ' HB ' ' A' ' 103' ' ' THR . 65.6 m-80 -71.66 -44.42 64.34 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.459 179.504 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.437 ' CD1' HG21 ' A' ' 16' ' ' ILE . 23.2 mm -60.53 -52.1 65.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.14 0.495 . . . . 0.0 110.679 179.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -62.2 -30.88 71.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.799 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 41.8 mtm -78.56 -40.45 34.76 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.855 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.435 HG21 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -76.06 -42.99 45.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.874 -179.879 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 18.0 mt -60.73 -37.07 80.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.772 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -63.43 -29.75 70.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.836 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -67.4 -37.1 82.57 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.972 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.452 ' CG2' ' CE2' ' A' ' 111' ' ' TYR . 3.5 mt -68.51 -44.08 83.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.294 -179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.427 ' H ' HG13 ' A' ' 108' ' ' ILE . 2.5 mt -60.83 -61.21 1.66 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.589 0 CA-C-O 121.847 0.832 . . . . 0.0 109.393 179.08 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 27.5 m -53.27 -28.85 29.9 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.172 -1.376 . . . . 0.0 110.853 179.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 51.4 mtt-85 -72.45 -33.74 67.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.666 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.452 ' CE2' ' CG2' ' A' ' 107' ' ' ILE . 22.3 m-30 -87.99 -31.12 19.52 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.842 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.289 0 CA-C-O 121.045 0.45 . . . . 0.0 110.64 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.4 t . . . . . 0 CA--C 1.527 0.078 0 CA-C-O 120.866 0.365 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 78.0 m80 63.59 32.68 13.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.244 0.545 . . . . 0.0 111.039 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.649 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 80.6 p 178.47 172.99 0.7 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.688 178.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.412 ' CA ' ' CG1' ' A' ' 96' ' ' VAL . . . 153.17 117.2 0.67 Allowed Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.028 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.557 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -39.82 117.85 0.8 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.897 0.379 . . . . 0.0 111.224 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.46 ' N ' ' O ' ' A' ' 14' ' ' GLY . . . -134.47 152.03 51.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.738 -179.114 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.564 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.2 mp -98.39 126.69 51.41 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.263 0 CA-C-O 121.138 0.494 . . . . 0.0 110.78 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.507 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 9.5 t80 -118.82 128.66 54.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.724 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 82.4 mt-10 59.02 36.79 24.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.595 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.421 ' HB2' ' O ' ' A' ' 10' ' ' GLU . 1.6 mtmt 72.13 2.43 4.31 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.31 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.466 ' O ' ' N ' ' A' ' 9' ' ' PHE . 30.0 t -102.37 146.68 10.03 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.71 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.564 ' HA ' HG13 ' A' ' 8' ' ' ILE . 88.0 p -85.96 146.71 26.56 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.595 -179.294 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.46 ' O ' ' N ' ' A' ' 7' ' ' ALA . . . -177.33 -179.1 47.47 Favored Glycine 0 N--CA 1.442 -0.907 0 CA-C-N 115.168 -0.924 . . . . 0.0 111.758 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.557 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.0 mm -104.48 137.57 32.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-O 120.951 0.405 . . . . 0.0 110.229 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.649 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -106.73 118.22 54.05 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 178.758 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.537 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -125.63 124.44 41.19 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.162 0.506 . . . . 0.0 111.484 -178.01 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.431 ' CD1' HG21 ' A' ' 103' ' ' THR . 76.5 mt -98.72 139.24 21.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.04 -179.444 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -130.93 112.31 12.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.954 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -86.62 0.63 54.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.341 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -76.57 -17.79 59.02 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 121.029 0.442 . . . . 0.0 110.283 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -95.99 134.86 32.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.858 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -111.37 116.68 50.59 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.016 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -78.21 154.05 92.9 Favored 'Cis proline' 0 C--N 1.349 0.554 0 C-N-CA 123.387 -1.505 . . . . 0.0 112.125 0.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -49.3 138.34 12.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.891 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -134.26 162.54 31.9 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.174 0.512 . . . . 0.0 111.517 -179.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.8 tt -121.25 125.39 46.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.536 179.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.2 m -113.24 126.95 55.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.156 0.503 . . . . 0.0 112.295 -178.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.46 ' CD2' ' CB ' ' A' ' 9' ' ' PHE . 64.2 t90 -100.41 128.97 46.33 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.914 178.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.9 ttm105 -128.31 117.94 22.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.824 179.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.418 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 17.0 t -44.73 155.88 0.09 Allowed 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.768 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.431 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -65.06 -39.62 93.53 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.529 0.681 . . . . 0.0 109.349 -179.925 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -79.99 -25.32 40.35 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 114.634 -1.166 . . . . 0.0 111.132 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 90.97 31.65 9.71 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.662 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -101.9 -21.2 14.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.61 0.243 . . . . 0.0 111.442 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 11.8 mtmt -128.69 138.33 52.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.764 0.316 . . . . 0.0 111.141 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 47.4 t -139.09 132.85 39.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.032 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.507 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 65.5 t60 -136.65 146.31 45.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.137 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 49.0 m -127.68 139.1 52.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.107 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 96.1 t -128.49 140.91 47.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.183 0.516 . . . . 0.0 111.674 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.467 ' CG1' ' CG2' ' A' ' 44' ' ' THR . 2.0 p -87.64 118.17 32.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.386 -0.825 . . . . 0.0 109.22 178.215 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 89.2 mt -73.5 -30.72 63.31 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -178.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.14 -24.3 10.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.819 0.342 . . . . 0.0 111.69 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.467 ' CG2' ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -92.58 -24.67 18.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.103 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 39.2 mm -61.25 85.44 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.712 -179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -70.81 -29.04 65.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.543 -179.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.624 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 10.0 mmmt -139.35 146.44 40.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.024 0.44 . . . . 0.0 111.789 -179.234 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -126.74 126.36 43.34 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.741 179.138 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -119.87 149.45 42.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.971 0.415 . . . . 0.0 111.236 -179.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.407 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . . . -148.08 146.76 28.97 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.953 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 54.6 p -75.87 122.73 87.57 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.332 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -61.42 160.32 27.99 Favored 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 122.597 2.198 . . . . 0.0 112.578 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.68 -42.75 93.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.103 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 86.3 p -57.92 -26.94 62.87 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.044 0.45 . . . . 0.0 110.783 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.7 t -85.69 118.57 25.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.845 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -56.69 -18.5 12.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.542 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -63.54 147.1 52.31 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.954 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 19.6 mmm -133.74 85.0 2.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.592 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.414 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 31.7 mtm -154.67 165.87 35.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.229 0.538 . . . . 0.0 112.002 -179.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.407 ' CD1' ' HB3' ' A' ' 50' ' ' ALA . 2.8 tp -133.79 126.81 31.4 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.997 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.1 ttt180 -117.1 127.18 53.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.928 0.394 . . . . 0.0 111.882 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.446 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -106.42 144.1 33.59 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.269 179.482 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.624 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 2.0 mm -111.27 126.04 68.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.818 0.342 . . . . 0.0 111.211 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -91.25 131.91 11.01 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.2 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -44.3 137.84 3.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.847 0.356 . . . . 0.0 111.245 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.477 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.4 p -93.85 -162.39 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.052 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.477 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 52.1 t0 -167.38 73.28 0.12 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.088 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 85.6 mt-10 -55.11 -21.97 14.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.439 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 37.1 m -57.06 -19.01 16.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.174 179.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.78 -54.57 43.56 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.986 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.5 mmtt 60.92 93.64 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.838 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 10.8 mtt180 -111.22 143.83 41.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.835 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.1 mttp -98.48 145.21 27.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.168 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -87.65 175.25 7.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.899 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -64.31 -19.52 65.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.39 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 51.8 mp0 -86.95 6.39 32.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.59 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.47 14.59 82.33 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.766 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -104.65 148.96 25.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.767 0.317 . . . . 0.0 110.548 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -82.62 142.82 31.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.874 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.433 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.3 m -134.3 158.87 42.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.224 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 30.7 t -101.38 98.81 9.78 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.724 178.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.433 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 95.3 Cg_exo -42.99 145.4 1.17 Allowed 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.491 2.127 . . . . 0.0 112.681 -178.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.475 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 15.4 mttt -82.67 147.8 56.38 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.057 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 13.8 Cg_exo -74.18 160.69 42.09 Favored 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 123.394 2.729 . . . . 0.0 112.713 -179.121 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.53 151.31 46.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.668 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.81 120.99 7.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.096 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -99.48 158.47 15.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.419 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.2 ttt -133.62 132.46 40.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.026 0.441 . . . . 0.0 111.477 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.494 ' CE2' ' CD1' ' A' ' 9' ' ' PHE . 96.6 m-85 -138.93 146.25 40.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.367 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.414 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 6.1 t -121.96 133.76 54.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.948 0.404 . . . . 0.0 111.282 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.442 ' CD1' ' N ' ' A' ' 91' ' ' PHE . 3.3 m-85 -123.47 171.26 9.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.718 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -130.89 20.49 4.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.171 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 45.1 t-20 -152.1 113.98 4.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.812 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 -55.62 -31.74 62.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.914 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.03 -55.05 14.03 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.043 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.412 ' CG1' ' CA ' ' A' ' 5' ' ' GLY . 57.6 t -59.06 -47.68 89.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.338 179.449 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.436 ' HG3' ' CD1' ' A' ' 91' ' ' PHE . 16.4 ttp -64.46 -29.45 70.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.96 179.091 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -65.6 -34.08 77.41 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.403 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.4 ' O ' ' HB ' ' A' ' 103' ' ' THR . 60.2 m-80 -69.15 -40.44 78.2 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.591 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.428 ' CD1' HG21 ' A' ' 16' ' ' ILE . 24.3 mm -65.56 -52.12 54.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.739 179.68 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.07 -28.28 69.98 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.85 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 40.7 mtm -78.78 -40.81 32.13 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.66 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.431 HG21 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -75.52 -36.71 60.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.896 -179.97 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 13.5 mt -62.24 -40.37 95.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.876 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.32 -27.66 69.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.949 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -69.39 -40.36 77.44 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.996 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 4.0 mt -65.58 -44.99 93.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.296 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.401 ' O ' ' N ' ' A' ' 112' ' ' LYS . 2.1 mt -59.7 -61.0 1.66 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.608 0 CA-C-O 121.692 0.758 . . . . 0.0 109.259 179.057 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.5 t -50.97 -28.96 10.99 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.301 -1.318 . . . . 0.0 110.906 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 53.5 mtt-85 -68.48 -33.75 74.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.06 0.457 . . . . 0.0 110.576 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -105.44 -1.2 25.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.892 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.401 ' N ' ' O ' ' A' ' 108' ' ' ILE . 0.7 OUTLIER . . . . . 0 C--N 1.331 -0.238 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.821 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.6 p . . . . . 0 C--O 1.233 0.188 0 CA-C-O 120.653 0.263 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.448 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 50.5 m80 65.74 35.76 6.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.094 0.473 . . . . 0.0 111.373 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.482 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 68.5 p -178.35 152.05 0.65 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.908 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.404 ' CA ' ' CG1' ' A' ' 96' ' ' VAL . . . 176.17 116.53 0.46 Allowed Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.139 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.581 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -46.77 104.35 0.05 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.146 0.498 . . . . 0.0 111.386 -179.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.459 ' O ' ' O ' ' A' ' 14' ' ' GLY . . . -119.26 152.4 36.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.753 -178.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.528 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.9 OUTLIER -100.63 125.76 54.4 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.267 0 CA-C-O 121.09 0.471 . . . . 0.0 110.469 179.0 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.506 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 4.3 t80 -113.3 130.78 56.17 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.125 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 81.8 mt-10 55.88 35.0 24.63 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.046 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 42.9 mtpt 75.78 1.49 3.55 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.362 -179.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.526 ' O ' HG21 ' A' ' 8' ' ' ILE . 41.0 t -99.8 155.46 4.14 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.616 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.528 ' HA ' HG13 ' A' ' 8' ' ' ILE . 71.9 p -98.44 148.58 23.57 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.572 0.701 . . . . 0.0 112.643 -178.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.459 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 175.86 -179.58 46.91 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 114.595 -1.184 . . . . 0.0 110.344 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.581 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.69 142.15 20.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 117.613 0.707 . . . . 0.0 110.465 179.344 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.482 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -106.68 118.45 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.766 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.561 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.405 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -119.3 137.79 53.45 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.234 -178.565 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.455 ' CD1' HG23 ' A' ' 103' ' ' THR . 64.8 mt -110.66 140.11 31.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.094 -179.101 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 -132.27 111.63 11.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.08 -179.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -91.14 3.44 54.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.2 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -78.81 -17.23 56.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.883 0.373 . . . . 0.0 110.469 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.87 141.66 16.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.941 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.405 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.3 t -114.37 116.58 43.94 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.747 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.411 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 1.6 Cg_endo -81.33 142.62 56.22 Favored 'Cis proline' 0 C--N 1.347 0.489 0 C-N-CA 123.818 -1.326 . . . . 0.0 111.904 -0.068 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.06 141.59 3.17 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.054 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -135.77 167.12 21.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.102 0.477 . . . . 0.0 111.739 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.5 tt -121.26 129.84 53.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.582 179.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.7 m -117.34 126.82 53.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.225 0.536 . . . . 0.0 112.156 -178.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.469 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 58.8 t90 -100.62 128.3 46.72 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.895 178.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.6 tpt180 -124.98 116.94 22.95 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.783 0.325 . . . . 0.0 111.065 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.442 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 12.5 m -45.49 166.23 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.01 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.75 -41.63 64.93 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.517 0.675 . . . . 0.0 109.526 179.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -84.66 -20.0 31.99 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.006 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.39 33.6 11.49 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.41 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -100.7 -22.85 14.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.658 0.266 . . . . 0.0 111.446 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 4.5 mtmt -130.23 137.56 50.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.777 0.322 . . . . 0.0 111.025 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 14.6 p -139.16 132.31 38.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.059 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.506 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 62.1 t60 -131.38 145.94 52.05 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.045 0.45 . . . . 0.0 111.222 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 48.5 m -129.12 134.48 48.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.025 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.9 t -126.71 140.81 47.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.031 0.443 . . . . 0.0 111.447 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.462 ' CG1' HG21 ' A' ' 44' ' ' THR . 1.9 p -85.54 117.55 30.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.446 ' HA ' HG12 ' A' ' 45' ' ' ILE . 83.6 mt -75.39 -31.69 60.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.244 -0.434 . . . . 0.0 112.097 -178.552 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.411 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 10.9 t -53.95 -23.36 12.76 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -179.072 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.462 HG21 ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -92.07 -21.24 20.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.716 0.293 . . . . 0.0 111.014 -179.736 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.446 HG12 ' HA ' ' A' ' 42' ' ' LEU . 36.4 mm -57.75 87.03 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.995 0.426 . . . . 0.0 111.067 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.416 ' N ' ' O ' ' A' ' 63' ' ' ILE . 21.8 t70 -64.77 -32.57 74.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.0 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.694 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 4.4 mmmt -142.67 149.7 39.22 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.055 0.455 . . . . 0.0 111.28 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.465 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -131.98 125.95 32.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.778 179.175 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -136.79 158.91 43.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.994 0.426 . . . . 0.0 111.431 -179.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -148.12 166.49 27.7 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.958 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 81.4 p -75.65 148.33 82.49 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.823 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.82 149.59 86.56 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.587 2.191 . . . . 0.0 112.362 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.82 -36.38 83.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.176 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.6 t -59.96 -26.29 65.88 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.994 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 24.1 t -86.62 117.09 25.16 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.918 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -56.98 -18.62 14.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.539 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.4 mttp -83.95 127.88 34.16 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.945 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.425 ' HE3' ' HA ' ' A' ' 92' ' ' ASN . 2.0 ttm -102.02 149.88 23.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.935 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 178.38 138.91 0.09 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.914 0.388 . . . . 0.0 111.269 179.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.6 tp -126.1 123.92 39.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.122 179.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 20.8 mmt85 -110.14 123.56 49.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.929 0.395 . . . . 0.0 111.72 -179.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.438 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -109.25 128.07 54.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.372 179.466 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.694 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -105.63 122.69 59.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.576 -0.283 . . . . 0.0 110.986 179.871 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.89 -129.27 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.464 -0.874 . . . . 0.0 111.843 179.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.3 mttp -130.13 155.08 46.79 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.629 0.252 . . . . 0.0 110.516 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.471 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.2 p -118.78 -164.01 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.928 0.395 . . . . 0.0 111.243 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.471 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 21.1 t70 -178.94 75.66 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.186 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 55.7 mp0 -55.0 -22.49 15.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.446 -179.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 37.6 m -58.24 -18.34 25.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.127 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.2 -61.4 1.83 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.907 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp 62.96 94.4 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.94 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.6 mtt180 -97.15 141.49 30.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.984 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.4 ' HA ' ' HA ' ' A' ' 79' ' ' GLU . 55.8 mmtt -78.76 145.13 34.57 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.911 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.3 p30 -97.23 175.85 6.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.068 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -60.59 -19.68 58.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.333 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -87.08 7.48 27.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.512 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.78 13.7 80.4 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.738 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -111.01 145.42 38.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.825 0.345 . . . . 0.0 110.845 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.4 ' HA ' ' HA ' ' A' ' 73' ' ' LYS . 96.9 mt-10 -72.16 143.13 49.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.069 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.457 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 1.3 m -140.59 151.82 20.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.072 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.3 p -85.62 108.62 17.1 Favored Pre-proline 0 C--N 1.319 -0.745 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.62 178.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.457 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 46.0 Cg_exo -56.72 145.98 79.64 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.125 1.883 . . . . 0.0 112.257 -178.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 18.6 mtmt -83.12 148.12 55.62 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.034 0.445 . . . . 0.0 110.882 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo -74.28 158.71 44.64 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 C-N-CA 123.342 2.695 . . . . 0.0 112.695 -179.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.47 136.31 56.28 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.61 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 32.2 mtm105 -134.69 138.31 44.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.852 0.358 . . . . 0.0 111.214 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -118.15 157.03 27.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.358 179.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 8.5 ttt -133.58 120.48 20.79 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.95 0.405 . . . . 0.0 111.372 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.493 ' CE2' ' CD1' ' A' ' 9' ' ' PHE . 97.0 m-85 -126.24 133.05 51.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.574 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -106.09 133.63 50.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.885 0.374 . . . . 0.0 111.147 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.418 ' CZ ' ' HB1' ' A' ' 7' ' ' ALA . 2.5 m-85 -122.74 170.45 10.05 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.575 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.425 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 5.7 m120 -121.57 -22.83 5.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.801 0.334 . . . . 0.0 111.304 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -108.1 100.2 9.56 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.38 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -47.8 -30.16 3.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.111 0.481 . . . . 0.0 111.111 -179.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.45 -47.58 54.82 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.227 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.404 ' CG1' ' CA ' ' A' ' 5' ' ' GLY . 57.5 t -61.31 -50.22 81.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.395 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 41.8 ttp -62.49 -29.61 70.67 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 178.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -60.31 -34.49 73.86 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 121.098 0.475 . . . . 0.0 109.953 179.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -71.56 -33.68 69.31 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.891 178.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.457 HD12 ' CG2' ' A' ' 16' ' ' ILE . 19.6 mm -61.8 -47.83 91.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.586 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -67.47 -27.97 67.47 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.21 0.528 . . . . 0.0 110.357 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 77.5 mtp -78.55 -39.41 37.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.505 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.455 HG23 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -76.43 -40.54 50.39 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.714 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 18.9 mt -63.78 -36.83 85.19 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.85 0.357 . . . . 0.0 110.516 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -63.3 -29.37 70.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.973 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -68.98 -31.5 70.39 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.141 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 4.2 mt -76.49 -46.15 32.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.479 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . . . . . . . . . 2.2 mt -57.1 -61.38 1.28 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.568 0 CA-C-O 121.746 0.784 . . . . 0.0 109.544 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 18.2 t -50.27 -28.84 8.4 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.396 -1.275 . . . . 0.0 110.462 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.36 -35.01 79.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.671 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -89.55 -31.28 17.69 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.869 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.255 0 CA-C-O 120.956 0.408 . . . . 0.0 110.603 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.861 0.362 . . . . 0.0 111.019 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 79.4 m80 64.16 33.44 11.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.234 0.54 . . . . 0.0 110.981 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.608 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 53.0 p 179.33 174.62 0.75 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.62 179.086 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 153.53 120.03 0.77 Allowed Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.466 -0.874 . . . . 0.0 112.522 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.58 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -47.21 105.76 0.07 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.151 0.501 . . . . 0.0 111.34 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.446 ' CB ' ' CE2' ' A' ' 91' ' ' PHE . . . -120.49 151.52 39.25 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.761 -178.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.542 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -99.67 124.26 52.94 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.256 0 CA-C-O 121.014 0.435 . . . . 0.0 110.29 179.046 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.495 ' CZ ' ' CD2' ' A' ' 38' ' ' HIS . 16.9 t80 -112.7 130.38 56.08 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.112 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.417 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 83.4 mt-10 56.4 34.21 23.79 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.037 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.0 mttm 76.24 1.35 3.39 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.249 -179.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.532 ' O ' HG21 ' A' ' 8' ' ' ILE . 40.6 t -99.71 154.42 4.26 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.671 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 178.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.542 ' HA ' HG13 ' A' ' 8' ' ' ILE . 78.0 p -97.31 148.47 23.1 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-O 121.604 0.716 . . . . 0.0 112.546 -178.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.436 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 175.59 -179.72 46.61 Favored Glycine 0 N--CA 1.447 -0.627 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.397 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.58 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.66 142.2 20.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 117.74 0.77 . . . . 0.0 110.521 179.369 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.608 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -106.69 118.56 54.64 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.758 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 179.557 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.474 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -121.3 134.46 55.15 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.315 -178.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.435 ' CD1' HG22 ' A' ' 103' ' ' THR . 96.7 mt -111.04 140.09 31.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.194 -179.158 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -128.72 112.65 14.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.004 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -87.36 6.16 34.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.267 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -78.34 -18.31 55.34 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.912 0.387 . . . . 0.0 110.411 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -100.39 146.76 8.57 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.859 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.5 t -121.51 115.5 31.07 Favored Pre-proline 0 CA--C 1.532 0.269 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.957 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.402 ' HB3' ' CB ' ' A' ' 43' ' ' SER . 5.6 Cg_exo -77.67 145.28 79.06 Favored 'Cis proline' 0 C--N 1.348 0.501 0 C-N-CA 123.633 -1.403 . . . . 0.0 111.842 -0.078 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -44.15 140.81 1.98 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.818 0.342 . . . . 0.0 110.916 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -124.69 157.72 34.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.132 0.491 . . . . 0.0 111.716 -179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.434 ' O ' ' HA ' ' A' ' 39' ' ' THR . 4.4 tt -121.28 128.9 52.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.494 179.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.9 m -119.63 125.79 49.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.143 0.496 . . . . 0.0 112.168 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.473 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 60.2 t90 -100.49 127.79 46.74 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.727 178.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 44.8 ttp85 -122.0 117.15 25.68 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.798 0.333 . . . . 0.0 111.013 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.429 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 64.0 m -46.66 162.93 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.913 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.83 -41.57 68.0 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.536 0.684 . . . . 0.0 109.551 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -82.14 -21.14 36.78 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.803 -1.09 . . . . 0.0 111.044 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.09 34.48 12.64 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.329 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 51.9 t0 -104.0 -19.4 14.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.615 0.245 . . . . 0.0 111.614 -179.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.57 142.17 45.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.888 0.375 . . . . 0.0 111.327 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 48.6 t -139.26 138.05 40.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.925 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.495 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 50.9 t60 -134.55 145.77 49.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.207 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.434 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 43.5 m -129.31 134.86 48.12 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.175 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 90.8 t -135.04 139.69 46.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 CA-C-O 121.127 0.489 . . . . 0.0 111.836 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.481 ' CG1' HG23 ' A' ' 44' ' ' THR . 1.6 p -88.63 117.46 32.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.505 177.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.49 ' HA ' HG12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -73.95 -28.28 61.43 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -179.035 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.417 ' HB2' ' CE2' ' A' ' 111' ' ' TYR . 11.9 t -55.96 -21.59 21.77 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.157 0.429 . . . . 0.0 112.157 -179.161 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.481 HG23 ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -96.54 -21.9 17.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.833 0.349 . . . . 0.0 111.413 -179.446 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.49 HG12 ' HA ' ' A' ' 42' ' ' LEU . 47.6 mm -53.18 94.19 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.028 0.442 . . . . 0.0 111.053 -179.751 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -61.15 -28.87 69.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.393 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.609 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 16.3 mttm -153.41 162.92 40.78 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.167 0.508 . . . . 0.0 111.603 -179.711 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 22.2 mt -123.88 124.36 42.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.362 179.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -111.07 130.34 55.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.621 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.81 138.84 25.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.218 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 57.2 p -75.75 122.05 86.29 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.496 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -62.6 160.54 31.83 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.563 2.175 . . . . 0.0 112.49 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.92 -43.14 91.06 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.131 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.2 m -60.85 -27.71 68.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.06 0.457 . . . . 0.0 110.63 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 26.3 t -79.48 122.03 25.93 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.97 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -56.61 -18.74 13.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.284 179.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -65.46 151.83 45.4 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.72 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.505 ' HE1' ' HA ' ' A' ' 92' ' ' ASN . 48.5 mtp -143.0 79.82 1.66 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.98 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -155.71 169.02 25.32 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.016 0.436 . . . . 0.0 111.569 -179.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -135.85 126.82 27.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.147 179.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 32.8 mtp180 -119.06 129.9 55.34 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.93 0.395 . . . . 0.0 111.657 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.468 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.1 141.81 36.85 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.397 179.613 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.609 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.1 mm -105.15 112.84 40.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.687 0.279 . . . . 0.0 111.326 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -83.82 125.36 7.03 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.605 -0.807 . . . . 0.0 112.36 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 50.6 mttt -49.46 153.6 1.07 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.826 0.346 . . . . 0.0 111.185 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.439 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.3 p -117.65 -161.9 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.061 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.439 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 23.5 m-20 -167.37 62.21 0.08 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.496 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -49.58 -28.27 5.47 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.402 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 36.9 m -54.44 -18.83 4.66 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.118 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.7 mmtp -62.44 -37.3 85.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.858 0.361 . . . . 0.0 110.988 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.6 mptt 61.37 93.48 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.864 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 -104.72 157.3 17.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.861 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -111.27 145.5 38.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.896 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 35.7 p30 -93.07 174.45 7.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.987 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -62.14 -18.36 60.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.393 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -86.95 7.98 25.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.556 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.93 11.25 81.23 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.718 -0.754 . . . . 0.0 112.694 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -106.55 146.09 31.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.844 0.354 . . . . 0.0 110.709 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -73.77 148.83 42.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.971 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.456 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.4 m -136.11 159.05 38.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.982 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.9 t -100.54 98.74 8.54 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.701 178.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.456 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 79.8 Cg_exo -44.17 145.13 2.42 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.402 2.068 . . . . 0.0 112.789 -179.085 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.417 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 8.6 mtmt -95.11 151.05 38.53 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.879 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 18.0 Cg_exo -71.4 143.43 43.14 Favored 'Trans proline' 0 N--CA 1.465 -0.198 0 C-N-CA 123.48 2.786 . . . . 0.0 112.746 -178.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.1 mm-40 -65.37 151.47 46.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.02 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 90.5 mtt180 -148.79 119.78 7.68 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.565 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -98.71 150.88 21.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.759 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -128.47 122.23 30.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.13 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.455 ' CE2' ' CD1' ' A' ' 9' ' ' PHE . 93.2 m-85 -127.2 155.1 43.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.604 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 35.7 t -129.35 134.96 48.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.906 0.384 . . . . 0.0 110.953 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.446 ' CD1' ' N ' ' A' ' 91' ' ' PHE . 3.0 m-85 -127.48 147.99 50.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.685 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.505 ' HA ' ' HE1' ' A' ' 58' ' ' MET . 47.6 m-20 -95.33 -24.03 16.92 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.242 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -106.59 115.53 30.35 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.806 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -57.29 -31.28 65.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.936 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.02 -45.06 90.58 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.233 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 57.4 t -58.24 -44.19 87.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.754 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.429 ' HG2' ' CG ' ' A' ' 91' ' ' PHE . 3.2 mtm -60.72 -32.24 71.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.316 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 48.8 t0 -64.06 -29.98 71.09 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.881 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -80.89 -50.17 10.1 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.02 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.426 ' CD1' HG23 ' A' ' 16' ' ' ILE . 23.5 mm -58.68 -52.26 62.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.005 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -61.16 -32.08 71.81 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.952 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 33.4 mtm -78.86 -40.36 32.76 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.166 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.435 HG22 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -72.16 -41.32 67.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.275 -179.552 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 12.5 mt -64.05 -38.42 91.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.789 0.328 . . . . 0.0 110.775 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -65.61 -28.81 69.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.764 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -68.52 -35.94 78.16 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.673 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 57.8 mt -68.35 -46.7 80.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.081 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.443 ' H ' HG13 ' A' ' 108' ' ' ILE . 2.2 mt -59.02 -61.12 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.508 -0.637 0 CA-C-O 121.809 0.814 . . . . 0.0 109.218 179.099 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 8.5 t -50.53 -28.72 9.07 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.379 -1.282 . . . . 0.0 110.434 179.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.45 -48.94 68.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.412 0.625 . . . . 0.0 109.841 179.336 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.417 ' CE2' ' HB2' ' A' ' 43' ' ' SER . 39.4 m-85 -75.36 -28.99 59.77 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.291 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 11.4 mttm . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.662 179.621 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.1 m . . . . . 0 C--O 1.23 0.046 0 CA-C-O 120.892 0.377 . . . . 0.0 110.892 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.405 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 54.8 m80 -113.05 34.0 4.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.164 0.507 . . . . 0.0 111.046 -179.722 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.487 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 36.5 p -170.48 145.42 2.61 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.547 179.137 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -177.69 116.91 0.56 Allowed Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.375 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.581 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -45.65 105.15 0.06 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.094 0.473 . . . . 0.0 111.437 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.453 ' O ' ' O ' ' A' ' 14' ' ' GLY . . . -120.59 151.42 39.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.905 -178.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.543 HG21 ' O ' ' A' ' 12' ' ' VAL . 0.8 OUTLIER -100.3 124.55 53.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.998 0.428 . . . . 0.0 110.425 179.145 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.501 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 11.1 t80 -112.79 130.58 56.03 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.179 179.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 56.14 34.24 23.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.007 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 25.8 mttp 76.38 1.06 3.32 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.334 -179.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.543 ' O ' HG21 ' A' ' 8' ' ' ILE . 41.7 t -99.35 154.93 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.633 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 178.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.534 ' HA ' HG13 ' A' ' 8' ' ' ILE . 98.1 p -98.05 148.72 23.23 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-O 121.67 0.748 . . . . 0.0 112.794 -178.647 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.453 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 175.52 -179.79 46.51 Favored Glycine 0 N--CA 1.446 -0.672 0 CA-C-N 114.452 -1.249 . . . . 0.0 110.285 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.581 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.61 143.13 17.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 117.688 0.744 . . . . 0.0 110.403 179.372 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.487 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -106.58 118.26 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 CA-C-N 115.335 -0.848 . . . . 0.0 108.767 179.575 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -121.52 124.58 44.75 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.2 0.524 . . . . 0.0 111.389 -178.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.441 ' CD1' HG21 ' A' ' 103' ' ' THR . 53.6 mt -94.52 140.03 17.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.903 -179.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -127.37 111.53 13.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.079 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -95.81 5.39 51.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.239 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -79.71 -17.4 53.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.962 0.41 . . . . 0.0 110.538 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -102.96 145.39 12.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.938 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.4 t -119.67 116.41 33.24 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.86 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -77.81 144.44 76.5 Favored 'Cis proline' 0 C--N 1.348 0.552 0 C-N-CA 123.491 -1.462 . . . . 0.0 112.332 0.09 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -50.7 151.4 2.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.88 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -137.62 165.75 25.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.201 0.524 . . . . 0.0 111.838 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.8 tt -121.24 121.98 38.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.325 179.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 41.0 m -112.56 124.93 53.64 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.47 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 56.3 t90 -100.65 127.74 46.95 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.875 178.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.17 118.33 27.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.852 0.358 . . . . 0.0 111.195 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 25.5 t -46.04 167.76 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.047 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.46 -42.43 59.07 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.481 0.658 . . . . 0.0 109.677 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 89.7 m-20 -89.11 -17.02 30.1 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.771 -1.104 . . . . 0.0 111.109 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.94 33.35 11.09 Favored Glycine 0 C--N 1.332 0.359 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.362 -179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -95.46 -22.15 17.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.594 0.235 . . . . 0.0 111.492 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.6 143.08 37.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.826 0.346 . . . . 0.0 111.365 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 14.5 p -139.24 137.62 41.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.893 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.501 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 30.2 t60 -131.28 145.64 51.97 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.97 0.414 . . . . 0.0 111.218 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 40.9 m -129.09 136.03 49.69 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.959 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.401 HG11 ' N ' ' A' ' 41' ' ' VAL . 77.5 t -130.07 141.73 45.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.235 0.54 . . . . 0.0 111.788 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.405 ' HB ' ' CG2' ' A' ' 44' ' ' THR . 0.0 OUTLIER -85.31 118.11 31.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.649 178.029 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.411 ' CD1' ' CD1' ' A' ' 107' ' ' ILE . 27.6 mt -66.89 -19.55 65.75 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.804 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.5 t -67.76 -25.43 65.62 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.799 179.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.432 ' O ' ' N ' ' A' ' 65' ' ' LYS . 0.1 OUTLIER -87.1 -37.68 17.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.825 179.864 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.486 HG22 ' CB ' ' A' ' 62' ' ' LEU . 8.9 mm -58.31 87.99 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.492 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -83.96 -25.53 29.97 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.77 -178.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.527 ' HB2' HG12 ' A' ' 63' ' ' ILE . 13.6 mttp -125.17 158.0 35.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.21 0.529 . . . . 0.0 111.902 -179.098 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.421 HD12 ' N ' ' A' ' 105' ' ' GLN . 28.8 mt -131.44 128.84 40.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.556 179.168 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.419 ' N ' ' O ' ' A' ' 61' ' ' ARG . 35.8 tt0 -129.54 130.38 45.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.885 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.51 137.66 28.65 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.019 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 31.6 p -75.67 126.24 87.53 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.8 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.43 160.74 46.44 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.509 2.139 . . . . 0.0 112.449 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.96 -42.95 81.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.11 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.0 m -61.5 -27.64 68.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.052 0.453 . . . . 0.0 110.697 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.3 m -77.48 121.68 24.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.879 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -56.22 -18.82 11.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.322 179.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.54 140.88 42.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.774 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.443 ' HE1' ' HA ' ' A' ' 92' ' ' ASN . 33.3 mtp -130.89 79.92 1.92 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.737 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -150.83 168.75 23.49 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.135 0.493 . . . . 0.0 111.579 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.437 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.3 OUTLIER -137.84 123.78 20.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.973 179.474 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.419 ' O ' ' N ' ' A' ' 49' ' ' GLN . 40.4 ttt180 -127.93 136.78 51.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.795 0.331 . . . . 0.0 111.689 -179.238 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.486 ' CB ' HG22 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -119.41 144.09 47.12 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.443 179.227 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.527 HG12 ' HB2' ' A' ' 47' ' ' LYS . 1.1 mm -101.08 134.23 41.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.827 0.346 . . . . 0.0 110.986 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -82.73 153.22 31.13 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.186 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.432 ' N ' ' O ' ' A' ' 44' ' ' THR . 38.4 mttt -60.12 163.13 5.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.709 0.29 . . . . 0.0 110.735 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.49 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.4 p -116.9 -163.43 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 121.018 0.437 . . . . 0.0 111.279 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.49 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 56.0 m-20 -160.59 71.14 0.43 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.092 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -55.51 -20.9 14.36 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.534 -179.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 31.0 m -53.71 -21.69 7.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.797 0.332 . . . . 0.0 111.124 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.8 mtmm -76.32 -48.71 19.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.965 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 60.66 92.83 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.949 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 10.9 mtm180 -94.48 129.25 41.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.824 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.405 ' HA ' ' HA ' ' A' ' 79' ' ' GLU . 29.1 mmtp -81.21 145.3 31.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.045 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -92.65 179.83 5.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.955 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -64.93 -18.84 65.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.333 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -87.82 -2.84 58.87 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.274 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.69 8.23 73.77 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.699 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 22.7 p30 -105.58 145.99 30.24 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.883 0.373 . . . . 0.0 110.93 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.405 ' HA ' ' HA ' ' A' ' 73' ' ' LYS . 49.5 mt-10 -71.83 143.78 49.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.92 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.437 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.8 m -138.86 158.77 30.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.165 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 37.4 t -83.88 110.22 24.01 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.437 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 88.3 Cg_exo -46.8 169.67 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.217 1.944 . . . . 0.0 112.758 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.484 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.1 OUTLIER -90.4 95.88 0.81 Allowed Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.215 -179.873 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.484 ' HD2' ' HA ' ' A' ' 83' ' ' LYS . 7.9 Cg_endo -46.53 161.45 0.18 Allowed 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 123.41 2.74 . . . . 0.0 112.363 179.289 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -65.48 159.92 23.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.655 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -155.23 133.15 11.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.24 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -118.52 133.3 55.98 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.314 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 22.7 ttt -113.95 137.29 51.88 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.986 0.422 . . . . 0.0 111.47 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.446 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 99.0 m-85 -139.27 151.22 46.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.486 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -123.27 135.24 54.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.893 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.442 ' CD1' ' N ' ' A' ' 91' ' ' PHE . 2.8 m-85 -128.42 160.31 32.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.951 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.443 ' HA ' ' HE1' ' A' ' 58' ' ' MET . 68.4 m-20 -110.64 9.96 22.89 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.277 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -141.64 107.75 5.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.636 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.9 tmm_? -49.02 -30.28 5.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.272 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.56 -55.11 6.73 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.451 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 56.4 t -55.39 -48.17 77.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.873 0.368 . . . . 0.0 110.707 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.42 ' HB3' ' CG ' ' A' ' 91' ' ' PHE . 15.4 ptm -63.82 -38.03 89.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.917 179.148 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -61.47 -34.36 75.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.365 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -66.92 -41.45 87.06 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.631 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.416 HD12 ' CG2' ' A' ' 16' ' ' ILE . 27.2 mm -60.69 -52.37 62.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.853 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.16 -27.87 67.65 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.254 179.534 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 39.7 mtm -78.11 -36.89 47.43 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.72 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.441 HG21 ' CD1' ' A' ' 18' ' ' ILE . 0.5 OUTLIER -79.47 -39.85 31.21 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.497 179.815 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 28.1 mt -59.99 -35.69 75.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.764 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.421 ' N ' HD12 ' A' ' 48' ' ' LEU . 1.9 mt-30 -61.39 -32.18 72.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.796 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -65.64 -28.17 68.91 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.076 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.411 ' CD1' ' CD1' ' A' ' 42' ' ' LEU . 3.1 mt -81.11 -44.14 20.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.634 -179.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.402 HD12 HD12 ' A' ' 48' ' ' LEU . 2.2 mt -58.19 -61.35 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.585 0 CA-C-O 121.603 0.716 . . . . 0.0 109.444 179.402 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.7 p -49.08 -31.14 7.37 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.48 -1.236 . . . . 0.0 110.366 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -61.78 -41.8 98.18 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.568 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -85.3 -29.07 24.85 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.428 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 11.6 mttm . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.524 179.424 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.527 0.086 0 CA-C-O 120.901 0.382 . . . . 0.0 111.08 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 75.6 m80 63.93 31.9 13.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.195 0.521 . . . . 0.0 111.042 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.627 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 88.4 p 178.15 172.7 0.66 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.744 178.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.407 ' CA ' ' CG1' ' A' ' 96' ' ' VAL . . . 154.64 116.32 0.57 Allowed Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.746 -0.74 . . . . 0.0 111.966 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.554 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -40.39 117.56 0.82 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.846 0.355 . . . . 0.0 111.144 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.495 ' HB1' ' HB ' ' A' ' 16' ' ' ILE . . . -132.67 149.7 52.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.844 -178.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.562 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.1 mp -97.46 124.2 50.25 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 CA-C-O 121.023 0.44 . . . . 0.0 110.528 179.282 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.506 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 10.1 t80 -115.8 129.4 56.42 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.927 179.658 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 58.71 33.91 23.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.794 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.0 mttp 75.63 1.64 3.62 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.142 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.481 ' O ' HG23 ' A' ' 8' ' ' ILE . 32.7 t -100.94 151.42 5.34 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.694 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.562 ' HA ' HG13 ' A' ' 8' ' ' ILE . 85.3 p -90.36 145.89 24.6 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 121.435 0.636 . . . . 0.0 111.678 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.435 ' O ' ' N ' ' A' ' 7' ' ' ALA . . . -176.64 -179.22 46.96 Favored Glycine 0 N--CA 1.444 -0.817 0 CA-C-N 114.979 -1.009 . . . . 0.0 111.691 -179.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.554 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.9 mm -105.61 137.52 35.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 121.034 0.445 . . . . 0.0 110.194 179.667 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.627 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -106.54 117.92 53.24 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.672 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.538 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -124.4 131.07 53.5 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.366 -177.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.421 ' CD1' HG21 ' A' ' 103' ' ' THR . 89.0 mt -106.45 140.04 25.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.27 -179.261 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -132.25 112.49 12.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.971 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -90.95 6.14 45.85 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.215 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -79.44 -17.53 54.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.872 0.368 . . . . 0.0 110.529 179.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -100.2 143.27 14.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.972 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.9 t -115.15 116.26 42.36 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.821 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -80.52 143.64 64.55 Favored 'Cis proline' 0 C--N 1.349 0.576 0 C-N-CA 123.701 -1.374 . . . . 0.0 111.928 -0.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.21 141.3 4.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.732 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 68.4 mt-10 -134.5 166.24 23.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.172 0.51 . . . . 0.0 111.877 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.5 tt -121.33 127.58 51.43 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.555 179.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 41.0 m -116.6 129.61 56.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.212 0.53 . . . . 0.0 112.13 -178.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.481 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 56.3 t90 -100.47 125.69 46.81 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.984 178.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -122.61 117.3 25.52 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.71 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 30.3 t -44.48 158.96 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.752 0.311 . . . . 0.0 110.88 -179.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.424 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -66.42 -39.48 88.97 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 121.616 0.722 . . . . 0.0 109.352 179.9 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 42.8 p30 -89.46 -18.93 25.78 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.296 179.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.04 32.0 11.3 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.672 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -99.29 -18.88 17.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.725 0.297 . . . . 0.0 111.467 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.8 mtmt -134.97 140.6 45.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.089 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.2 t -139.11 137.09 42.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.897 0.38 . . . . 0.0 111.294 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.506 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 82.5 t60 -137.7 146.3 43.6 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.088 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 47.8 m -129.07 138.0 51.6 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.216 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.5 t -132.15 140.87 46.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 121.095 0.474 . . . . 0.0 111.421 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.454 ' CG1' HG23 ' A' ' 44' ' ' THR . 2.3 p -86.02 117.84 31.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.051 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.448 ' HA ' HG12 ' A' ' 45' ' ' ILE . 78.7 mt -75.47 -31.2 60.17 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.095 0.405 . . . . 0.0 112.095 -178.539 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 58.3 p -55.63 -21.86 19.81 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.122 0.415 . . . . 0.0 112.122 -178.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.454 HG23 ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -96.28 -21.84 17.59 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.756 0.312 . . . . 0.0 111.271 -179.785 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.455 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 38.0 mm -50.19 95.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.059 0.457 . . . . 0.0 111.039 -179.755 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -67.68 -27.94 67.26 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.317 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.593 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 38.4 mttm -156.72 159.89 38.79 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.045 0.45 . . . . 0.0 111.569 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -131.73 128.16 38.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.777 179.357 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -119.59 141.02 49.65 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.937 0.399 . . . . 0.0 111.071 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.85 143.25 31.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.992 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 43.0 p -75.7 111.21 13.33 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.597 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -64.56 160.59 39.09 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.559 2.173 . . . . 0.0 112.621 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.21 -41.84 72.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.186 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.0 m -58.12 -27.54 63.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.115 0.484 . . . . 0.0 110.788 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 31.4 t -86.29 118.65 25.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.817 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -57.18 -18.36 15.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.476 179.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -72.95 145.64 46.62 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.061 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.44 ' HE1' ' HA ' ' A' ' 92' ' ' ASN . 59.1 mtp -129.9 95.13 3.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.583 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 3.1 tmm? -175.36 148.65 0.96 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.053 0.454 . . . . 0.0 111.266 -179.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.419 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -114.32 145.7 41.45 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.368 179.694 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.1 mtt-85 -130.88 131.68 44.68 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.004 0.43 . . . . 0.0 111.726 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.452 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -111.48 142.06 44.25 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.361 179.41 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.593 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.6 mm -103.51 150.17 7.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.746 0.308 . . . . 0.0 110.8 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -114.32 134.72 11.92 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.234 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 19.8 mttt -54.33 147.07 14.17 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.75 0.31 . . . . 0.0 110.877 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.446 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.2 p -115.0 -162.98 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.346 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.446 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 52.1 t0 -178.69 76.58 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.102 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -53.71 -23.83 12.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.424 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 42.3 m -61.93 -15.39 42.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.104 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.5 mmtp -64.02 -45.09 90.48 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.753 0.311 . . . . 0.0 111.067 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.9 mmtt 64.09 95.83 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.893 0.377 . . . . 0.0 110.79 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 26.1 mmt85 -106.54 146.99 29.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.849 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -104.04 145.16 30.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.966 0.413 . . . . 0.0 110.969 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 43.6 p30 -87.6 176.91 7.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.991 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -65.1 -16.97 64.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.357 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -86.43 6.66 29.22 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.518 -179.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.16 9.65 86.68 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.759 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.2 m-80 -101.31 161.15 13.83 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.763 0.316 . . . . 0.0 110.775 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -90.51 150.42 21.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.887 0.375 . . . . 0.0 110.927 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.462 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.7 m -140.5 158.72 24.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.167 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 20.4 t -86.72 108.89 20.16 Favored Pre-proline 0 C--N 1.326 -0.45 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 178.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.462 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 78.2 Cg_exo -50.23 145.29 20.94 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.111 1.874 . . . . 0.0 112.466 -178.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.462 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 7.4 mtpt -110.66 151.56 42.9 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.054 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 15.1 Cg_exo -73.41 155.03 50.98 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 C-N-CA 123.589 2.859 . . . . 0.0 112.642 -178.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -87.13 155.35 20.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.413 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 18.4 ttp180 -141.79 119.72 11.97 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.749 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 13.0 m-70 -94.64 136.33 35.06 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.221 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -120.48 112.14 18.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.914 0.388 . . . . 0.0 111.541 -179.5 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.506 ' CE2' ' CD1' ' A' ' 9' ' ' PHE . 86.4 m-85 -118.12 125.19 49.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.156 179.16 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -95.06 128.8 42.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.968 0.413 . . . . 0.0 111.236 -179.502 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.463 ' CE2' ' HB1' ' A' ' 7' ' ' ALA . 75.2 m-85 -113.44 145.55 40.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.81 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.44 ' HA ' ' HE1' ' A' ' 58' ' ' MET . 7.2 m120 -107.75 25.3 11.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.911 179.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -151.91 108.6 3.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.519 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 24.3 mtm-85 -52.0 -29.38 20.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.231 -179.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.12 -54.99 5.83 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.464 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.407 ' CG1' ' CA ' ' A' ' 5' ' ' GLY . 46.0 t -54.25 -47.14 68.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.813 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.39 -34.36 75.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.964 0.412 . . . . 0.0 110.21 179.337 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.411 ' O ' ' HB3' ' A' ' 102' ' ' MET . 50.6 t0 -63.63 -33.61 76.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.78 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 38.2 m-80 -67.45 -36.96 82.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.168 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.446 HG13 ' CZ ' ' A' ' 91' ' ' PHE . 22.8 mm -66.31 -49.22 77.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.739 179.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.27 -27.52 68.69 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.726 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.411 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -78.71 -40.91 32.36 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.165 179.654 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.421 HG21 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -74.23 -39.6 62.96 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.755 -179.898 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 13.2 mt -62.01 -41.03 97.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.714 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -62.95 -27.28 69.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.994 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -70.47 -32.01 69.37 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.96 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 5.8 mt -75.93 -46.19 35.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.504 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.413 ' H ' HG13 ' A' ' 108' ' ' ILE . 2.0 mt -56.67 -61.34 1.25 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.585 0 CA-C-O 121.742 0.782 . . . . 0.0 109.635 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 11.5 t -51.0 -28.8 10.74 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.43 -1.259 . . . . 0.0 110.373 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.37 -40.13 95.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.344 179.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -84.14 -29.81 26.39 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.28 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 9.7 mttm . . . . . 0 C--N 1.332 -0.193 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.496 179.502 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.5 p . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.691 0.282 . . . . 0.0 111.377 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.412 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 74.5 m80 -153.03 36.0 0.48 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.154 0.502 . . . . 0.0 110.917 -179.71 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.471 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 11.7 p -175.04 134.21 0.33 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.649 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -162.2 119.29 0.87 Allowed Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.417 179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.605 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -43.86 106.12 0.06 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.204 0.526 . . . . 0.0 111.298 -179.612 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.438 ' HB2' ' HB ' ' A' ' 16' ' ' ILE . . . -120.15 152.08 38.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.916 -178.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.526 HG23 ' O ' ' A' ' 12' ' ' VAL . 0.8 OUTLIER -100.1 124.79 53.78 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.252 0 CA-C-O 120.959 0.409 . . . . 0.0 110.241 178.876 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.498 ' CZ ' ' CD2' ' A' ' 38' ' ' HIS . 27.3 t80 -112.25 130.43 55.93 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.19 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.425 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 88.9 mt-10 55.24 34.83 23.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.906 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.9 mtpt 76.1 1.3 3.43 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.353 -179.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.526 ' O ' HG23 ' A' ' 8' ' ' ILE . 41.4 t -99.38 154.98 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.643 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.517 ' HA ' HG13 ' A' ' 8' ' ' ILE . 90.4 p -96.65 148.96 22.33 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-O 121.562 0.696 . . . . 0.0 112.595 -178.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.436 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 175.31 -179.68 46.39 Favored Glycine 0 N--CA 1.445 -0.749 0 CA-C-N 114.569 -1.196 . . . . 0.0 110.181 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.605 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.9 143.19 18.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 117.632 0.716 . . . . 0.0 110.637 179.47 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.486 HG21 HD12 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -106.76 118.63 54.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 179.571 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -119.03 129.13 54.95 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.168 0.508 . . . . 0.0 111.409 -178.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.448 ' CD1' HG21 ' A' ' 103' ' ' THR . 54.0 mt -102.9 140.07 22.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.934 -179.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 47.2 t-20 -132.48 111.42 11.26 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.913 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -93.23 4.64 53.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.247 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -78.95 -17.55 55.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.004 0.43 . . . . 0.0 110.437 179.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.64 140.75 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.92 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.5 t -112.94 116.93 46.93 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.767 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.4 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 1.1 Cg_endo -81.5 142.68 55.46 Favored 'Cis proline' 0 C--N 1.347 0.493 0 C-N-CA 123.878 -1.301 . . . . 0.0 112.054 0.082 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.58 142.85 5.53 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.88 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 72.9 mt-10 -136.03 167.19 21.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.126 0.489 . . . . 0.0 111.552 -179.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.3 tt -121.15 129.14 53.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.854 179.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.5 m -117.05 127.64 54.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.105 0.479 . . . . 0.0 112.011 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.492 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 57.0 t90 -100.57 130.05 46.58 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.111 179.151 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.5 ttt180 -124.97 116.29 21.93 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.938 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.408 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 10.6 m -45.45 163.85 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.042 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.88 -41.5 67.94 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 121.497 0.665 . . . . 0.0 109.551 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.2 t0 -83.3 -20.74 33.86 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.046 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.26 34.3 12.66 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.34 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -100.99 -21.24 15.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.572 0.225 . . . . 0.0 111.505 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.41 144.23 46.41 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.931 0.396 . . . . 0.0 111.329 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 11.7 p -139.4 137.76 40.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.011 179.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.498 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 13.6 t60 -132.31 145.53 51.34 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.859 0.361 . . . . 0.0 111.169 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 45.2 m -129.16 135.58 49.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.998 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.404 HG12 ' CD2' ' A' ' 87' ' ' HIS . 97.4 t -130.07 140.95 47.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.007 0.432 . . . . 0.0 111.642 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.462 ' CG2' HG23 ' A' ' 44' ' ' THR . 7.0 p -87.99 117.47 31.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.367 178.364 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.41 ' CD1' ' CD1' ' A' ' 107' ' ' ILE . 18.7 mt -76.02 -33.26 59.66 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -178.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.413 ' HB2' ' CZ ' ' A' ' 111' ' ' TYR . 39.4 t -57.18 -19.69 22.16 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.462 HG23 ' CG2' ' A' ' 41' ' ' VAL . 0.2 OUTLIER -101.58 -22.45 14.48 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.346 -179.614 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 39.8 mm -47.87 95.19 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.047 0.451 . . . . 0.0 110.999 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -66.73 -26.77 67.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.625 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.733 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 19.1 mttm -148.14 152.6 37.57 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.149 0.5 . . . . 0.0 111.942 -179.227 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -133.95 128.53 34.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.613 179.178 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -133.58 152.83 51.97 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.067 0.46 . . . . 0.0 111.437 -179.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -148.08 153.19 38.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.729 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 37.4 p -75.8 118.82 73.88 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.548 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -64.1 159.11 44.4 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.491 2.127 . . . . 0.0 112.565 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.93 -41.52 98.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.087 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.7 t -57.92 -27.48 63.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.845 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.9 t -85.97 117.91 25.12 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.83 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -57.15 -18.28 14.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.532 179.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.0 mmtm -74.94 140.54 43.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.935 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 10.7 mmm -120.44 115.47 23.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.444 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.64 169.13 1.72 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.112 0.482 . . . . 0.0 111.839 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.404 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -145.73 134.07 21.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.982 179.519 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.2 mtt180 -125.45 133.1 52.57 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.072 0.463 . . . . 0.0 112.138 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.424 ' N ' ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -112.97 131.23 55.84 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.128 179.292 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.733 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.2 mm -99.75 149.99 5.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.77 0.319 . . . . 0.0 111.069 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -120.53 137.74 12.33 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.37 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 24.0 mttp -53.7 141.92 24.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.871 0.367 . . . . 0.0 111.118 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.477 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.4 p -119.57 -161.52 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.799 179.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.477 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 23.8 t0 -165.76 58.94 0.11 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.399 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -57.78 -22.41 46.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.253 -179.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 40.8 m -61.24 -16.62 47.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.959 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.4 mtmt -74.45 -35.83 63.34 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.087 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.1 mttt 61.96 93.63 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.684 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 25.8 mmt85 -95.79 141.41 29.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.103 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 43.8 mmtt -89.9 145.64 24.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.956 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -93.07 172.21 8.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.839 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -60.32 -19.97 57.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.185 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -86.29 4.29 39.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.405 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.92 15.25 81.43 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.676 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -111.39 144.68 40.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.923 0.392 . . . . 0.0 110.967 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -70.73 148.99 47.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.038 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.433 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.4 m -134.17 158.94 42.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.03 179.815 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 33.6 t -100.23 98.99 8.54 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.103 -0.498 . . . . 0.0 109.781 178.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.433 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 85.3 Cg_exo -40.07 148.14 0.18 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.721 2.281 . . . . 0.0 113.034 -179.02 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.502 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -115.72 107.35 48.68 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.012 -179.938 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.502 ' HD2' ' HA ' ' A' ' 83' ' ' LYS . 1.8 Cg_endo -39.09 141.88 0.37 Allowed 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 123.543 2.829 . . . . 0.0 112.585 179.371 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 59.7 mm-40 -65.48 126.34 27.97 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.773 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -122.48 120.42 33.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.931 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.419 ' HB3' ' CE2' ' A' ' 89' ' ' PHE . 94.0 m-70 -98.57 139.23 34.6 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.578 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -121.53 107.86 12.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.256 -179.644 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.493 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 95.5 m-85 -114.94 125.43 53.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.462 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.02 136.15 35.69 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.019 0.437 . . . . 0.0 111.136 -179.57 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.433 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 92.5 m-85 -123.69 158.69 31.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.844 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 68.8 m-20 -115.56 -19.81 10.44 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.405 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -107.33 114.64 28.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.797 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 9.8 mtt85 -57.83 -29.22 64.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.07 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -77.02 -55.15 5.71 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.361 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.6 t -56.85 -45.29 83.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.934 0.397 . . . . 0.0 110.675 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.9 ppp? -63.84 -36.81 85.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.053 179.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -62.52 -33.3 74.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.446 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -67.18 -33.73 76.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.987 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.457 HD13 HG23 ' A' ' 16' ' ' ILE . 17.5 mm -69.83 -48.71 62.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.642 179.346 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.402 ' HA ' ' CD1' ' A' ' 48' ' ' LEU . 8.5 ptpt -64.4 -27.72 69.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.849 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.7 -41.2 31.7 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.447 179.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.448 HG21 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -77.21 -30.85 54.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.691 179.876 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.419 ' O ' HG13 ' A' ' 108' ' ' ILE . 13.5 mt -71.07 -38.63 72.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.788 179.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.445 ' CB ' ' CD2' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -68.4 -29.24 67.88 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.568 179.792 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -71.28 -33.59 69.89 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.709 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.41 ' CD1' ' CD1' ' A' ' 42' ' ' LEU . 16.3 mt -70.2 -47.96 64.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.016 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.459 ' H ' HG13 ' A' ' 108' ' ' ILE . 2.7 mt -57.79 -61.07 1.46 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.631 0 CA-C-O 121.862 0.839 . . . . 0.0 109.224 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 27.3 m -50.2 -28.81 8.15 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.376 179.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -65.11 -35.31 80.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.785 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.413 ' CZ ' ' HB2' ' A' ' 43' ' ' SER . 69.1 m-85 -89.53 -31.09 17.79 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.04 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.586 179.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.6 p . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.858 0.361 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 33.3 m80 65.15 32.97 9.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.229 0.537 . . . . 0.0 111.204 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.558 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 72.6 p 177.65 142.72 0.09 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.665 179.158 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -177.88 114.48 0.46 Allowed Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.327 179.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.596 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -44.72 100.12 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.204 0.526 . . . . 0.0 111.327 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.496 ' CB ' ' CE2' ' A' ' 91' ' ' PHE . . . -115.71 152.03 33.98 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.066 -178.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.55 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -97.7 124.04 50.45 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.193 178.922 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.504 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 18.7 t80 -112.03 130.31 55.91 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.186 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.42 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 38.9 mt-10 56.07 34.92 24.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.872 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 mtpm? 76.18 0.67 3.31 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.25 -178.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.525 ' O ' HG23 ' A' ' 8' ' ' ILE . 41.3 t -99.92 155.41 4.18 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.713 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.55 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -96.87 149.86 21.39 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 121.379 0.609 . . . . 0.0 112.48 -178.75 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.453 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 174.83 -179.76 45.93 Favored Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.511 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.596 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.96 141.11 22.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 117.68 0.74 . . . . 0.0 110.457 179.307 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.558 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -106.71 118.31 54.2 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 CA-C-N 115.312 -0.858 . . . . 0.0 108.685 179.737 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.418 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -119.75 138.57 53.24 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.201 -178.605 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.432 ' CD1' HG22 ' A' ' 103' ' ' THR . 96.4 mt -112.78 140.08 34.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.327 -178.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -127.08 114.01 17.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.903 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -86.86 5.85 34.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.279 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -79.36 -17.54 54.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.868 0.366 . . . . 0.0 110.426 179.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.02 152.0 5.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.984 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.2 t -129.73 114.74 17.94 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.883 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.82 147.25 89.05 Favored 'Cis proline' 0 C--N 1.349 0.578 0 C-N-CA 123.296 -1.543 . . . . 0.0 111.955 0.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -45.44 136.85 5.27 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.557 179.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -116.95 152.94 33.51 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.376 0.608 . . . . 0.0 112.03 -178.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.424 ' HB2' HD11 ' A' ' 42' ' ' LEU . 2.9 tt -121.3 130.6 53.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.147 179.166 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.9 m -120.52 127.33 52.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.159 0.504 . . . . 0.0 112.049 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.504 ' CH2' ' HB3' ' A' ' 9' ' ' PHE . 60.6 t90 -100.56 126.77 47.04 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.706 179.044 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 38.1 ttt180 -121.35 116.56 25.04 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.854 0.359 . . . . 0.0 110.875 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.407 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 0.9 OUTLIER -45.48 166.92 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.083 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.87 -42.04 61.34 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 121.541 0.686 . . . . 0.0 109.702 179.657 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -82.69 -20.68 35.65 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.837 -1.074 . . . . 0.0 111.121 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.47 34.4 12.05 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.292 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -103.9 -19.71 14.15 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 -179.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.06 144.04 47.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.892 0.377 . . . . 0.0 111.372 -179.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 47.5 t -139.52 140.04 37.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.037 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.498 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 80.8 t60 -134.33 146.22 49.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.052 179.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.423 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 46.4 m -129.15 135.91 49.49 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.337 -179.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 84.7 t -139.24 140.54 37.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 CA-C-O 121.066 0.46 . . . . 0.0 111.645 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.477 ' CG1' HG22 ' A' ' 44' ' ' THR . 1.9 p -88.31 117.6 32.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 177.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.54 ' HA ' HG12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -74.28 -35.91 63.76 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -178.277 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.42 ' OG ' ' CE2' ' A' ' 111' ' ' TYR . 8.3 m -50.04 -25.94 3.88 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -178.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.477 HG22 ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -87.17 -23.52 24.78 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.167 -179.668 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.54 HG12 ' HA ' ' A' ' 42' ' ' LEU . 44.3 mm -50.05 96.66 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.129 0.49 . . . . 0.0 110.917 -179.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.423 ' N ' ' O ' ' A' ' 63' ' ' ILE . 16.7 t0 -72.44 -22.93 61.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.954 -179.232 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.43 ' HB2' HG13 ' A' ' 63' ' ' ILE . 43.4 mttm -157.27 137.91 13.12 Favored 'General case' 0 CA--C 1.522 -0.133 0 C-N-CA 120.422 -0.511 . . . . 0.0 111.949 -179.449 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 15.3 mt -106.34 124.04 48.99 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.903 178.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 91.9 mm-40 -115.51 133.26 56.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.801 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -142.99 146.34 33.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.057 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 74.9 p -75.63 130.56 78.94 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.687 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -67.02 160.21 48.35 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.49 2.127 . . . . 0.0 112.519 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.07 -42.87 95.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.02 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 87.1 p -60.63 -26.47 67.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.773 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.6 m -77.36 120.16 21.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.861 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -56.98 -18.1 12.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.409 179.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -67.28 155.96 37.57 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.956 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 44.0 mtp -142.96 80.5 1.69 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.725 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 10.4 tmm? -162.35 149.37 13.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.453 -179.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.35 152.98 32.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.479 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -137.91 135.41 36.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.995 0.426 . . . . 0.0 111.886 -179.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.462 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -103.53 144.24 31.68 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.384 179.501 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.43 HG13 ' HB2' ' A' ' 47' ' ' LYS . 1.2 mm -116.47 122.65 70.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.059 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.63 151.92 20.56 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.415 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.8 mttt -70.47 136.41 49.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.845 0.355 . . . . 0.0 111.001 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.488 ' CG2' ' N ' ' A' ' 67' ' ' ASP . 1.4 p -70.15 160.51 5.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.299 0.571 . . . . 0.0 111.312 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.488 ' N ' ' CG2' ' A' ' 66' ' ' VAL . 0.5 OUTLIER -113.18 130.69 56.13 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.784 179.901 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -95.0 3.63 54.71 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.453 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 24.0 t -72.08 -9.99 59.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.326 -179.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.71 -69.1 0.77 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.757 0.313 . . . . 0.0 111.176 -179.758 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.6 mmtt 62.47 94.23 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.788 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 16.6 mtt-85 -108.17 153.13 23.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.037 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.5 mmtp -93.28 147.73 22.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.986 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -90.47 176.71 6.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.005 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -63.75 -18.67 64.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.272 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -88.57 -5.89 57.9 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.344 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 91.88 9.52 62.4 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.711 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 -105.95 145.15 31.67 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.892 0.377 . . . . 0.0 110.965 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -72.3 144.08 48.48 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.915 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.412 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.3 m -132.3 158.82 43.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.175 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 32.5 t -101.5 98.8 9.95 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.678 178.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.412 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 99.2 Cg_exo -42.0 158.54 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.597 2.198 . . . . 0.0 112.743 -179.113 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.426 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.1 OUTLIER -69.86 149.96 96.51 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-O 121.115 0.483 . . . . 0.0 111.055 -179.874 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 16.8 Cg_exo -72.34 164.14 36.52 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 123.473 2.782 . . . . 0.0 112.622 -179.073 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 -65.55 157.36 29.93 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.692 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 62.3 mtm180 -150.11 119.82 7.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.799 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.421 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 36.2 m-70 -105.32 159.06 16.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.465 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -126.67 144.6 50.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.213 0.53 . . . . 0.0 111.681 -179.503 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.491 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 97.7 m-85 -157.51 125.21 5.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.119 179.406 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 22.6 t -109.36 139.86 43.79 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.899 0.381 . . . . 0.0 111.387 -179.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.513 ' CD1' ' N ' ' A' ' 91' ' ' PHE . 0.8 OUTLIER -126.76 146.57 50.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.521 179.681 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -87.21 -18.04 31.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.312 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -109.43 119.43 39.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.819 0.343 . . . . 0.0 110.741 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.62 -31.83 66.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.986 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.91 -46.73 73.92 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.168 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 48.3 t -59.86 -34.2 55.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.484 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.466 ' HG2' ' CG ' ' A' ' 91' ' ' PHE . 0.2 OUTLIER -63.59 -37.55 87.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.523 179.568 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -71.06 -36.61 72.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.86 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -60.22 -47.39 86.16 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.762 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.416 ' CD1' HG21 ' A' ' 16' ' ' ILE . 24.5 mm -65.46 -48.98 80.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.888 179.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.23 -27.61 68.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.898 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 44.6 mtm -78.65 -37.79 41.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.466 179.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.432 HG22 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -79.43 -38.97 33.49 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.744 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 30.2 mt -64.7 -39.62 93.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.591 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -61.92 -31.09 71.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.519 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -68.52 -35.45 77.49 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.666 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 58.2 mt -68.22 -48.49 73.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.957 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.442 ' H ' HG13 ' A' ' 108' ' ' ILE . 2.7 mt -59.93 -61.07 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.508 -0.668 0 CA-C-O 121.663 0.744 . . . . 0.0 109.06 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.5 m -49.74 -28.94 6.81 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.248 -1.342 . . . . 0.0 110.81 179.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 31.3 mtt-85 -66.97 -34.8 78.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.707 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.42 ' CE2' ' OG ' ' A' ' 43' ' ' SER . 86.6 m-85 -96.41 -30.62 13.27 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.888 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.413 ' CD ' ' CG2' ' A' ' 108' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.626 179.693 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.0 m . . . . . 0 C--O 1.23 0.065 0 CA-C-O 120.714 0.292 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -137.9 34.02 2.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.174 0.511 . . . . 0.0 110.828 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.514 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 49.9 p 179.97 120.43 0.06 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.709 179.103 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.417 ' O ' ' C ' ' A' ' 6' ' ' ALA . . . -147.4 115.75 0.79 Allowed Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.781 -0.723 . . . . 0.0 111.963 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.529 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -34.2 118.68 0.39 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.794 0.33 . . . . 0.0 111.116 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.442 ' O ' ' O ' ' A' ' 14' ' ' GLY . . . -133.46 150.98 51.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.075 -178.734 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.58 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.4 mp -99.83 124.57 53.31 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 CA-C-O 121.157 0.503 . . . . 0.0 110.521 179.227 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.492 ' CD1' ' CE1' ' A' ' 89' ' ' PHE . 18.2 t80 -116.62 132.53 56.66 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.033 179.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.418 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 89.7 mt-10 57.41 33.48 23.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.741 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.5 mttm 75.29 1.24 3.65 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.001 -178.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.481 ' O ' ' N ' ' A' ' 9' ' ' PHE . 25.0 t -101.0 144.37 12.94 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.769 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.752 179.078 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.58 ' HA ' HG13 ' A' ' 8' ' ' ILE . 81.0 p -83.72 145.6 28.65 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.278 -179.568 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.442 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . -174.3 -179.12 44.71 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.844 -179.377 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.529 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 4.5 mm -105.37 135.27 44.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-O 120.914 0.388 . . . . 0.0 110.373 179.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.514 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.2 OUTLIER -106.44 118.01 53.3 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.884 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 178.634 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.436 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -122.08 128.69 51.63 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.345 0.593 . . . . 0.0 111.84 -177.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.421 ' CD1' HG21 ' A' ' 103' ' ' THR . 59.8 mt -101.77 140.01 21.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.787 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.406 ' ND2' ' CG2' ' A' ' 22' ' ' VAL . 50.2 p-10 -131.27 111.47 11.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.999 0.428 . . . . 0.0 111.168 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -92.4 4.01 54.29 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.419 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -78.35 -17.71 56.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.962 0.41 . . . . 0.0 110.414 179.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.406 ' CG2' ' ND2' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -100.88 151.32 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.015 -179.719 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.1 t -123.67 117.56 27.53 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.642 179.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.408 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 1.6 Cg_endo -79.74 145.65 73.81 Favored 'Cis proline' 0 C--N 1.348 0.517 0 C-N-CA 123.678 -1.384 . . . . 0.0 112.044 0.008 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.21 145.86 2.11 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.714 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -137.41 167.05 22.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.307 0.575 . . . . 0.0 111.983 -179.126 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.4 tt -125.86 124.67 41.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.388 179.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.5 m -116.69 130.53 56.79 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.147 0.499 . . . . 0.0 112.056 -178.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.489 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 58.7 t90 -100.63 129.01 46.49 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.241 179.096 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 45.4 ttt-85 -127.75 116.99 21.07 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.504 179.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.5 m -44.66 155.96 0.09 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.952 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.407 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -65.4 -39.35 92.07 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.638 0.732 . . . . 0.0 109.25 179.978 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -85.03 -23.1 28.76 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 114.68 -1.146 . . . . 0.0 111.129 179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.85 32.06 10.43 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.601 179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -94.71 -21.86 18.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.592 0.234 . . . . 0.0 111.48 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.47 147.02 44.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.902 0.382 . . . . 0.0 111.17 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 14.7 p -139.13 138.14 41.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.126 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.487 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 32.7 t60 -136.44 145.87 45.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.984 0.421 . . . . 0.0 111.173 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 40.3 m -129.2 137.25 51.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.998 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 88.2 t -134.1 140.85 45.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 121.186 0.517 . . . . 0.0 111.754 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.474 ' CG1' HG22 ' A' ' 44' ' ' THR . 1.7 p -87.95 117.77 32.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 178.024 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.405 ' HA ' HG12 ' A' ' 45' ' ' ILE . 58.2 mt -75.21 -29.66 60.39 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -178.607 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.414 ' HB2' ' CZ ' ' A' ' 111' ' ' TYR . 8.1 t -55.86 -22.16 23.76 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.109 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.474 HG22 ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -94.8 -21.63 18.59 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.137 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.405 HG12 ' HA ' ' A' ' 42' ' ' LEU . 39.3 mm -57.95 88.26 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.983 0.421 . . . . 0.0 110.922 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -70.04 -29.06 66.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.383 -179.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.647 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 18.2 mttm -138.99 142.36 38.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.969 0.414 . . . . 0.0 111.575 -179.294 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -124.71 124.41 42.11 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.609 179.134 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -116.82 139.32 50.74 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.049 -179.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.39 144.22 31.96 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.969 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 32.3 p -75.65 113.44 26.67 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.548 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.46 160.57 35.02 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.545 2.164 . . . . 0.0 112.643 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.01 -42.97 77.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.243 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.5 m -58.29 -27.63 64.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.725 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 23.4 t -85.06 118.2 24.49 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.891 179.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -56.22 -18.7 11.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.583 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -65.44 159.03 25.18 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.871 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.444 ' HE3' ' HA ' ' A' ' 92' ' ' ASN . 26.8 mtp -142.92 79.92 1.67 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.819 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 29.3 mtm -154.7 169.09 24.72 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.152 0.501 . . . . 0.0 111.633 -179.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.434 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -140.79 123.88 16.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.529 -0.759 . . . . 0.0 109.955 179.502 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 47.1 ttt180 -113.43 137.11 52.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.853 0.358 . . . . 0.0 111.789 -179.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.442 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -112.61 144.08 42.71 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.624 179.749 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.647 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 2.0 mm -114.79 124.32 71.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.025 179.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -90.37 129.93 9.99 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.466 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 48.3 mttt -45.9 152.43 0.37 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.738 0.304 . . . . 0.0 111.284 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.438 ' CG1' ' N ' ' A' ' 67' ' ' ASP . 1.0 OUTLIER -122.23 -162.89 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.865 -179.944 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.438 ' N ' ' CG1' ' A' ' 66' ' ' VAL . 9.7 t0 179.67 51.52 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.402 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -57.5 -22.3 43.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.402 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.9 m -63.89 -14.26 52.01 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.135 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.2 mtmt -70.14 -45.47 66.75 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.846 0.355 . . . . 0.0 111.307 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.1 mttm 61.42 93.31 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.672 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.83 151.44 25.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.001 -179.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.6 mmtm -86.16 145.44 27.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.076 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 43.7 p30 -95.77 177.45 5.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.896 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -60.28 -19.98 57.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.337 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -88.45 9.75 22.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.513 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 70.31 17.86 74.6 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.696 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -115.52 145.87 42.23 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.862 0.363 . . . . 0.0 110.754 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 55.7 mp0 -74.56 142.5 44.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.97 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.452 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.0 m -131.36 158.88 43.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.01 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.4 t -102.29 98.52 10.67 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.712 178.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.452 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 87.2 Cg_exo -45.83 163.49 0.09 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.493 2.129 . . . . 0.0 112.578 -179.089 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.451 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 21.5 mtpp -117.99 147.74 41.96 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.97 0.414 . . . . 0.0 110.991 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 16.5 Cg_exo -72.7 136.27 25.29 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 123.363 2.708 . . . . 0.0 112.665 -179.045 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 40.0 mm-40 -67.01 149.32 50.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.72 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.2 mtp85 -151.59 120.0 6.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.747 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -104.59 144.94 31.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.769 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.4 ttt -122.94 118.34 27.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.887 0.375 . . . . 0.0 111.224 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.492 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 93.7 m-85 -124.98 141.94 51.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.521 179.713 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 1.3 p -114.0 135.67 53.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.899 0.38 . . . . 0.0 111.054 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.434 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 23.8 m-85 -122.47 156.48 34.01 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.75 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.444 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 57.6 m-20 -118.78 20.3 12.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.111 179.713 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -147.9 110.2 4.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.844 0.354 . . . . 0.0 110.669 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 15.5 mtt-85 -54.46 -29.33 49.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.066 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -75.79 -55.04 6.01 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.356 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 46.6 t -56.08 -47.41 80.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.622 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.5 ppp? -63.06 -35.55 80.62 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.84 179.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -61.12 -35.19 76.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.397 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -67.9 -35.38 78.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.197 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.504 HD13 HG21 ' A' ' 16' ' ' ILE . 18.3 mm -70.73 -52.07 31.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.719 179.41 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.58 -28.04 69.06 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.862 179.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 46.3 mtm -78.46 -40.81 34.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.655 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.421 HG21 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -78.15 -31.84 49.96 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.624 179.916 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 14.0 mt -65.94 -39.89 90.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.887 0.375 . . . . 0.0 110.661 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -63.1 -28.43 70.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.037 179.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -70.25 -36.85 74.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.052 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 6.0 mt -69.47 -46.98 74.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.356 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.445 ' H ' HG13 ' A' ' 108' ' ' ILE . 2.3 mt -57.22 -61.11 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.597 0 CA-C-O 121.696 0.76 . . . . 0.0 109.584 179.278 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 29.9 m -51.51 -28.68 14.21 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.458 179.049 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 4.3 mtt-85 -66.27 -35.35 80.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.787 179.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.414 ' CZ ' ' HB2' ' A' ' 43' ' ' SER . 79.8 m-85 -93.13 -34.48 13.62 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.954 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 CA-C-O 120.982 0.42 . . . . 0.0 110.748 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.742 0.306 . . . . 0.0 111.024 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.448 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 52.3 m80 64.53 29.05 13.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.207 0.527 . . . . 0.0 111.367 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.501 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 0.9 OUTLIER -172.69 139.97 0.96 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.549 179.022 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.402 ' CA ' ' CG1' ' A' ' 96' ' ' VAL . . . -171.49 118.27 0.73 Allowed Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.319 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.598 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -47.84 100.2 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.18 0.514 . . . . 0.0 111.212 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.453 ' CB ' ' CE2' ' A' ' 91' ' ' PHE . . . -114.63 152.19 32.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.914 -178.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.537 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -100.57 123.72 53.68 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.259 0 CA-C-O 120.956 0.408 . . . . 0.0 110.414 178.998 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.5 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 14.4 t80 -111.3 131.16 55.37 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.173 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.424 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 37.1 mt-10 54.85 34.94 23.15 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.936 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.5 mttm 75.84 1.78 3.58 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.35 -179.178 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.53 ' O ' HG21 ' A' ' 8' ' ' ILE . 40.9 t -100.04 154.6 4.33 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.69 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 178.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.537 ' HA ' HG13 ' A' ' 8' ' ' ILE . 94.4 p -97.01 149.62 21.71 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.674 0.75 . . . . 0.0 112.776 -178.629 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.436 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 174.38 -179.84 45.46 Favored Glycine 0 N--CA 1.447 -0.623 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.241 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.598 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -107.15 141.93 21.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 117.801 0.801 . . . . 0.0 110.583 179.407 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.501 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.2 OUTLIER -106.73 118.43 54.44 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 CA-C-N 115.283 -0.871 . . . . 0.0 108.653 179.527 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.445 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -120.53 131.2 54.58 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.223 0.535 . . . . 0.0 111.213 -178.717 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.448 ' O ' ' HB3' ' A' ' 3' ' ' HIS . 76.9 mt -103.25 140.22 22.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.207 -179.08 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -131.54 111.46 11.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.882 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -90.61 6.35 44.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.214 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -79.28 -17.88 53.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.9 0.381 . . . . 0.0 110.448 179.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -100.25 143.04 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.095 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.0 t -115.33 116.47 41.79 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.722 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.419 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 1.5 Cg_endo -80.8 143.24 61.68 Favored 'Cis proline' 0 C--N 1.348 0.525 0 C-N-CA 123.816 -1.327 . . . . 0.0 111.956 -0.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.26 142.42 2.91 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.053 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -135.61 167.3 21.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.191 0.519 . . . . 0.0 111.57 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.8 tt -121.04 130.94 53.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.806 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 48.0 m -117.74 126.01 51.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.199 0.524 . . . . 0.0 112.074 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.489 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 56.9 t90 -100.58 129.09 46.47 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.075 179.07 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 26.2 ttt85 -123.94 117.57 25.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.91 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.9 t -45.51 166.53 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.102 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.77 -42.64 57.81 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-O 121.452 0.644 . . . . 0.0 109.62 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -86.46 -16.62 36.54 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.079 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.8 34.24 13.82 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.238 -179.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -97.75 -21.62 16.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.573 0.225 . . . . 0.0 111.6 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.99 146.76 41.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.027 0.442 . . . . 0.0 111.597 -179.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 47.5 t -139.56 140.49 36.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.769 179.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.5 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 38.1 t60 -135.55 145.58 47.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.023 0.44 . . . . 0.0 111.321 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 47.7 m -129.32 135.27 48.52 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.86 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.4 t -130.84 140.89 47.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 121.142 0.496 . . . . 0.0 111.612 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.465 ' CG1' HG23 ' A' ' 44' ' ' THR . 2.0 p -86.41 117.78 31.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 178.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.433 ' HA ' HG12 ' A' ' 45' ' ' ILE . 66.3 mt -75.39 -30.68 60.21 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.259 -0.428 . . . . 0.0 112.092 -178.618 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.419 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 11.4 t -55.64 -21.88 20.03 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 -178.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.465 HG23 ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -94.41 -21.57 18.86 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.718 0.294 . . . . 0.0 111.36 -179.673 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.433 HG12 ' HA ' ' A' ' 42' ' ' LEU . 37.3 mm -51.76 92.71 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.97 0.414 . . . . 0.0 111.091 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -66.07 -29.73 70.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.109 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.627 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 18.2 mttp -153.35 158.99 42.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.977 0.418 . . . . 0.0 111.302 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.43 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -131.66 128.82 39.86 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.948 179.381 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -119.92 144.97 47.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.93 0.395 . . . . 0.0 111.072 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -148.06 141.63 25.47 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.033 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 73.3 p -75.69 117.17 61.6 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.587 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -62.05 160.56 29.57 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.519 2.146 . . . . 0.0 112.564 -179.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.67 -43.11 80.08 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.095 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 84.3 p -62.32 -27.48 69.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.053 0.454 . . . . 0.0 110.558 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.4 m -79.72 120.52 24.13 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.844 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.4 tp10 -55.62 -19.02 8.98 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.453 179.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.51 141.13 50.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.9 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.459 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 63.5 mtp -131.25 79.81 1.9 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.542 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 38.3 mtm -155.79 169.09 25.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.163 0.506 . . . . 0.0 111.527 -179.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.7 tp -134.17 124.03 25.34 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.113 179.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 53.2 ttt180 -112.27 126.53 55.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.938 0.399 . . . . 0.0 111.783 -179.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.437 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -105.47 143.7 33.27 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.38 179.423 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.627 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.5 mm -108.78 121.98 62.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.744 0.307 . . . . 0.0 111.174 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -90.5 128.09 9.11 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.206 179.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 23.6 mttt -50.04 146.09 5.14 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.879 0.371 . . . . 0.0 111.164 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.444 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.4 p -111.14 -162.15 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.051 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.444 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 7.2 m-20 -173.03 71.62 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.245 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -55.73 -22.28 22.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.437 -179.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 26.8 t -59.35 -17.48 30.11 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.085 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 62.3 mmtt -64.8 -45.28 86.91 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.794 0.33 . . . . 0.0 111.025 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.3 mptt 61.63 94.08 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.747 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 26.2 mmt180 -90.74 165.77 13.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.888 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.8 mttp -125.54 147.4 49.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.129 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -78.35 172.43 13.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.746 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -57.67 -24.0 54.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.227 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 48.8 mp0 -95.1 19.59 10.27 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.28 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.52 9.23 84.62 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.901 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -67.3 -163.5 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.696 0.284 . . . . 0.0 110.799 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -137.95 138.19 38.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.715 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.456 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 1.8 m -140.62 156.32 23.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.221 0.534 . . . . 0.0 111.376 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.437 HG11 ' O ' ' A' ' 81' ' ' VAL . 3.0 p -99.12 98.96 7.16 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 114.993 -1.003 . . . . 0.0 109.916 179.257 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.456 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 96.8 Cg_exo -41.9 145.32 0.77 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.663 2.242 . . . . 0.0 112.853 -178.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.435 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 3.4 mmpt? -94.45 153.12 40.44 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.995 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 19.0 Cg_exo -71.55 141.65 38.67 Favored 'Trans proline' 0 N--CA 1.466 -0.133 0 C-N-CA 123.406 2.737 . . . . 0.0 112.7 -179.01 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -65.55 147.26 53.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.859 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.63 119.8 7.26 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.668 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -100.62 156.93 17.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.709 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.8 ttt -133.53 126.82 31.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.237 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.442 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 90.2 m-85 -134.22 148.19 50.82 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.518 179.625 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 38.7 t -128.56 133.1 48.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.952 0.406 . . . . 0.0 111.356 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.512 ' CD1' ' N ' ' A' ' 91' ' ' PHE . 0.7 OUTLIER -123.38 160.99 25.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.286 179.679 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.459 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 36.1 m-20 -114.3 28.36 8.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.846 0.355 . . . . 0.0 110.876 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -152.7 110.12 3.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.608 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.84 -31.17 37.68 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.016 0.436 . . . . 0.0 110.892 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.61 -54.87 11.91 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.944 179.808 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.402 ' CG1' ' CA ' ' A' ' 5' ' ' GLY . 50.8 t -58.76 -35.73 57.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.06 0.457 . . . . 0.0 110.332 179.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.46 ' HG3' ' CD1' ' A' ' 91' ' ' PHE . 1.7 ttp -66.74 -38.56 86.89 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.641 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.487 ' O ' ' HB3' ' A' ' 102' ' ' MET . 52.0 t0 -69.36 -35.32 75.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.769 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -61.57 -35.64 78.39 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.154 179.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.469 HD11 ' CG2' ' A' ' 16' ' ' ILE . 18.1 mm -71.69 -50.86 36.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.791 179.63 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 98' ' ' ASP . 1.0 OUTLIER -63.24 -27.37 69.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.798 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.487 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.7 OUTLIER -78.51 -41.74 31.52 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.201 179.626 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.434 HG22 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -71.92 -40.08 69.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.804 -179.999 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 13.6 mt -61.62 -38.8 88.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.764 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -63.42 -27.07 69.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.96 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -70.08 -34.07 72.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.124 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 3.8 mt -74.22 -45.83 46.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.561 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.414 ' CG2' ' CD ' ' A' ' 112' ' ' LYS . 2.3 mt -56.64 -61.25 1.28 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.542 0 CA-C-O 121.734 0.778 . . . . 0.0 109.5 179.388 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.1 t -49.45 -28.87 5.74 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.783 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 7.2 mtt-85 -67.5 -35.33 78.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.625 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -93.41 -31.88 14.45 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.729 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.414 ' CD ' ' CG2' ' A' ' 108' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.523 179.676 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.3 m . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.824 0.345 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.409 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 25.3 m80 64.37 30.52 13.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.173 0.511 . . . . 0.0 110.999 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.556 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 88.4 p 174.91 126.69 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.634 178.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.419 ' O ' ' C ' ' A' ' 6' ' ' ALA . . . -163.6 110.37 0.42 Allowed Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.868 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.551 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -33.11 116.33 0.23 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.812 0.339 . . . . 0.0 111.261 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.45 ' HB2' ' HB ' ' A' ' 16' ' ' ILE . . . -133.63 151.84 51.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.081 -0.508 . . . . 0.0 112.08 -178.744 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.564 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.0 OUTLIER -97.62 125.12 50.85 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.226 0 CA-C-O 121.062 0.458 . . . . 0.0 110.56 179.203 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.508 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 25.2 t80 -116.65 128.52 55.45 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.912 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.422 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 88.7 mt-10 59.31 33.58 22.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.721 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.7 mttt 75.94 1.87 3.56 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.183 -178.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.465 ' O ' HG22 ' A' ' 8' ' ' ILE . 35.2 t -101.13 152.07 5.22 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.755 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 178.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.564 ' HA ' HG13 ' A' ' 8' ' ' ILE . 83.4 p -90.65 146.0 24.39 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 121.377 0.608 . . . . 0.0 111.518 -179.384 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.436 ' O ' ' N ' ' A' ' 7' ' ' ALA . . . -177.07 -179.17 47.31 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.702 -179.565 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.551 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.4 mm -105.21 136.2 40.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 120.859 0.362 . . . . 0.0 110.285 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.556 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -106.58 117.89 53.23 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 178.934 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.455 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -124.17 133.73 53.49 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.359 -178.118 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.456 ' CD1' HG23 ' A' ' 103' ' ' THR . 82.6 mt -105.8 140.0 25.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.353 -179.031 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -131.36 114.81 15.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.841 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -92.83 5.33 51.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.364 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -78.95 -17.97 54.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.035 0.445 . . . . 0.0 110.383 179.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.25 143.48 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.866 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.8 m -117.78 119.66 33.69 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.861 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.418 ' CB ' ' HB3' ' A' ' 43' ' ' SER . 3.4 Cg_exo -78.71 141.1 62.53 Favored 'Cis proline' 0 C--N 1.348 0.548 0 C-N-CA 123.621 -1.408 . . . . 0.0 111.786 -0.151 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -43.59 137.68 2.83 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.01 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -130.24 165.04 23.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.159 0.504 . . . . 0.0 111.835 -179.049 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 7.0 tt -121.12 125.68 47.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.472 179.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.6 m -113.29 128.9 56.62 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.474 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 58.9 t90 -100.56 126.63 47.03 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.931 178.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.46 117.81 25.24 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.653 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 29.7 t -44.42 157.29 0.06 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.882 -179.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.43 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.2 OUTLIER -65.18 -39.11 92.44 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.624 0.726 . . . . 0.0 109.146 179.863 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 -85.24 -23.95 28.0 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.629 -1.169 . . . . 0.0 111.017 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 91.28 31.69 9.47 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.615 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -100.0 -19.94 16.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.696 0.284 . . . . 0.0 111.437 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.62 141.49 49.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.825 0.345 . . . . 0.0 111.092 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 13.5 p -139.13 135.02 41.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.27 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.508 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 70.8 t60 -135.07 146.32 48.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.201 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 40.0 m -126.58 140.52 52.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.077 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 93.3 t -134.68 140.93 44.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 121.118 0.485 . . . . 0.0 111.698 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.458 ' CG1' ' CG2' ' A' ' 44' ' ' THR . 1.5 p -86.02 118.09 31.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.491 ' HA ' HG12 ' A' ' 45' ' ' ILE . 46.3 mt -74.53 -30.15 61.66 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -178.313 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.418 ' HB3' ' CB ' ' A' ' 24' ' ' PRO . 60.2 p -56.14 -22.06 26.27 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -178.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.458 ' CG2' ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -90.82 -24.29 20.34 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.883 0.373 . . . . 0.0 111.331 -179.596 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.491 HG12 ' HA ' ' A' ' 42' ' ' LEU . 42.3 mm -57.78 92.04 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.806 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -80.42 -26.11 38.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.734 -179.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.659 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 19.4 mtmt -137.61 152.83 49.79 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.201 0.524 . . . . 0.0 112.049 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.472 HD12 ' N ' ' A' ' 105' ' ' GLN . 22.2 mt -116.28 124.41 50.11 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.032 179.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.407 ' CB ' ' HG3' ' A' ' 61' ' ' ARG . 10.4 mp0 -121.91 130.31 53.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.893 0.378 . . . . 0.0 110.823 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -144.66 143.92 30.98 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.965 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 72.7 p -75.67 123.74 88.52 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.46 179.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -61.1 154.54 56.57 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.597 2.198 . . . . 0.0 112.537 -179.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.17 -42.49 98.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.125 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.6 t -58.07 -27.61 63.8 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.05 0.452 . . . . 0.0 110.831 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.6 t -80.21 119.16 22.6 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.808 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -55.95 -18.65 9.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.521 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.3 mttm -81.4 126.23 31.36 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.94 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.459 ' HE1' ' HA ' ' A' ' 92' ' ' ASN . 28.4 mtp -107.93 117.62 34.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.593 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 1.7 ttm -174.59 167.97 3.79 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.185 0.517 . . . . 0.0 111.791 -179.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.412 HD21 ' CE1' ' A' ' 91' ' ' PHE . 1.6 tp -153.58 138.97 17.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.918 179.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.407 ' HG3' ' CB ' ' A' ' 49' ' ' GLN . 0.2 OUTLIER -139.98 148.09 41.39 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.005 0.431 . . . . 0.0 111.869 -179.649 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.495 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -109.47 144.34 37.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.582 179.919 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.659 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 2.5 mm -105.82 121.72 58.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.766 0.317 . . . . 0.0 111.112 179.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -86.07 131.39 10.48 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.313 179.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.4 mttt -46.34 150.63 0.61 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.702 0.287 . . . . 0.0 111.334 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.445 ' CG1' ' N ' ' A' ' 67' ' ' ASP . 1.3 p -116.86 -162.09 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.973 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.445 ' N ' ' CG1' ' A' ' 66' ' ' VAL . 25.9 m-20 -166.29 59.8 0.1 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.324 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 86.7 mt-10 -57.44 -21.5 37.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.411 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 32.7 t -58.6 -18.23 28.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.116 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -67.56 -51.43 50.77 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.887 0.375 . . . . 0.0 110.956 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.6 mttt 57.65 88.12 0.06 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.033 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.71 135.33 39.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.811 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 18.1 mmtm -75.24 144.84 42.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.313 -179.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -95.23 174.15 7.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.87 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -59.6 -19.88 51.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.324 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 49.3 mp0 -87.66 7.69 28.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.434 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.05 18.59 79.24 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.6 -0.81 . . . . 0.0 112.685 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -115.56 145.51 42.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.746 0.307 . . . . 0.0 111.024 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -76.45 146.32 38.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.897 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.413 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 1.3 m -133.7 158.72 42.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.213 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.2 t -103.55 98.68 13.21 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.724 178.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.413 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 87.4 Cg_exo -46.13 145.52 5.32 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 122.448 2.099 . . . . 0.0 112.438 -179.157 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 2.1 mptt -83.45 143.44 44.53 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.056 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 15.1 Cg_exo -73.55 152.56 48.72 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 123.558 2.839 . . . . 0.0 112.629 -178.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -67.2 147.76 52.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.585 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.8 mtp-105 -147.56 120.05 8.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.156 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -99.06 159.05 15.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.402 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 23.1 ttt -133.41 138.94 46.47 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.006 0.431 . . . . 0.0 111.567 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.495 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 95.3 m-85 -152.02 125.41 8.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.214 179.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.7 t -98.98 133.01 43.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.095 0.474 . . . . 0.0 111.314 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.44 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 80.7 m-85 -120.19 152.71 37.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.629 179.664 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.459 ' HA ' ' HE1' ' A' ' 58' ' ' MET . 16.7 m-20 -108.4 -6.62 16.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.371 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -121.64 108.73 13.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.871 0.367 . . . . 0.0 110.749 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.86 -28.62 3.88 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.112 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -76.28 -54.93 6.06 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.205 -179.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 58.9 t -53.42 -47.88 58.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.772 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.4 -35.68 78.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.222 179.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 54.5 t0 -64.63 -35.63 81.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.465 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 53.9 m-80 -65.45 -42.93 91.8 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.971 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.435 ' CD1' HG22 ' A' ' 16' ' ' ILE . 27.4 mm -62.38 -52.15 63.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.573 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 6.9 pttp -64.05 -27.87 69.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.657 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 38.4 mtm -78.84 -40.41 32.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.741 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.456 HG23 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -75.56 -43.52 48.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.016 -179.825 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.401 ' CD2' ' CD2' ' A' ' 42' ' ' LEU . 3.5 mt -61.43 -33.97 74.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.818 0.342 . . . . 0.0 110.981 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.472 ' N ' HD12 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -67.85 -26.51 66.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.696 -179.988 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -69.49 -30.1 67.89 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.559 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 3.9 mt -76.38 -45.37 34.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.244 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.433 ' H ' HG13 ' A' ' 108' ' ' ILE . 2.1 mt -57.87 -61.44 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.63 0 CA-C-O 121.669 0.747 . . . . 0.0 109.516 179.367 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.8 m -51.76 -28.81 16.49 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.284 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 3.9 mtt180 -64.41 -35.35 80.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.524 179.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -92.77 -28.86 16.32 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.781 179.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.405 ' CE ' HG21 ' A' ' 108' ' ' ILE . 2.0 mptp? . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.75 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.0 m . . . . . 0 CA--C 1.524 -0.033 0 CA-C-O 120.787 0.327 . . . . 0.0 111.07 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.408 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 66.3 m80 -141.35 34.99 1.67 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.136 0.493 . . . . 0.0 110.963 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.483 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 6.2 p -173.32 116.75 0.27 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.877 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -146.57 117.67 0.97 Allowed Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.391 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.599 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -41.38 108.69 0.1 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.178 0.513 . . . . 0.0 111.673 -179.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.44 ' O ' ' O ' ' A' ' 14' ' ' GLY . . . -122.35 153.04 39.52 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.974 -178.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.521 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -100.11 125.53 53.82 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.236 0 CA-C-O 120.956 0.408 . . . . 0.0 110.35 178.881 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.508 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 5.7 t80 -113.1 130.85 56.04 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.134 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 55.4 34.29 22.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.9 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 30.9 mttm 76.28 1.21 3.37 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.322 -179.046 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.512 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.6 t -99.69 154.29 4.27 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.641 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 178.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.521 ' HA ' HG13 ' A' ' 8' ' ' ILE . 90.6 p -95.65 149.2 21.72 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.579 0.704 . . . . 0.0 112.613 -178.671 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.44 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 175.42 -179.62 46.53 Favored Glycine 0 N--CA 1.446 -0.648 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.347 -179.797 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.599 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.71 142.65 19.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 117.608 0.704 . . . . 0.0 110.68 179.367 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.483 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.2 OUTLIER -106.77 118.49 54.62 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.764 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 179.48 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -118.28 123.91 46.55 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.334 -178.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.428 HD13 HG23 ' A' ' 18' ' ' ILE . 42.2 mt -96.74 138.46 21.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.995 -179.403 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 65.9 m-20 -131.03 114.2 14.89 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.988 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -91.92 5.93 48.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.169 179.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -78.95 -18.13 54.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.957 0.408 . . . . 0.0 110.313 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.78 145.24 10.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.886 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.0 t -119.44 115.65 33.96 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.967 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.41 ' HB2' ' CB ' ' A' ' 43' ' ' SER . 79.7 Cg_endo -78.06 146.3 80.54 Favored 'Cis proline' 0 C--N 1.348 0.53 0 C-N-CA 123.42 -1.492 . . . . 0.0 112.193 0.132 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.63 137.69 8.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.629 179.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -127.3 167.05 16.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.153 0.501 . . . . 0.0 111.701 -179.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.0 tt -121.16 130.58 53.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.8 179.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.3 m -116.6 123.93 48.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.117 0.484 . . . . 0.0 111.907 -179.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.475 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 58.5 t90 -100.63 128.93 46.51 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.073 179.311 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 8.5 ttm180 -124.68 116.32 22.18 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.824 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.434 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 28.8 t -45.24 164.13 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.091 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.51 -41.42 65.94 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.498 0.666 . . . . 0.0 109.611 179.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -81.13 -22.08 39.32 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.075 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.29 33.25 10.75 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.447 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -107.33 -21.12 13.05 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.658 0.266 . . . . 0.0 111.489 -179.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -127.2 134.41 50.13 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.862 0.363 . . . . 0.0 111.176 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.4 t -139.13 136.19 42.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.939 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.508 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 85.7 t60 -138.81 146.21 41.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.217 0.532 . . . . 0.0 111.387 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 49.6 m -126.09 139.41 53.41 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.893 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 95.8 t -131.77 140.87 47.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.094 0.474 . . . . 0.0 111.637 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.522 ' CG1' ' CG2' ' A' ' 44' ' ' THR . 1.4 p -85.35 118.06 31.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 178.022 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.461 ' HA ' HG12 ' A' ' 45' ' ' ILE . 61.2 mt -72.38 -30.23 64.49 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.212 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.41 ' CB ' ' HB2' ' A' ' 24' ' ' PRO . 2.3 t -53.91 -23.66 13.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.682 0.277 . . . . 0.0 111.641 -179.516 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.522 ' CG2' ' CG1' ' A' ' 41' ' ' VAL . 0.2 OUTLIER -84.56 -25.49 28.66 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.137 -179.855 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.461 HG12 ' HA ' ' A' ' 42' ' ' LEU . 45.6 mm -54.33 101.39 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.129 -179.505 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -95.78 -20.66 18.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.54 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.436 ' HB2' HG13 ' A' ' 63' ' ' ILE . 35.8 mttt -153.39 133.43 13.3 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.009 0.433 . . . . 0.0 111.302 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 54.0 mt -105.81 124.28 49.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.632 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -109.66 130.39 55.52 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.467 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -142.05 142.07 32.83 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.98 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 81.3 p -75.75 137.71 70.09 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.57 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.16 152.95 55.89 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.583 2.189 . . . . 0.0 112.503 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.01 -43.0 99.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.181 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.1 m -58.01 -27.63 63.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.697 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.4 m -82.35 119.99 24.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.795 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -57.2 -18.27 14.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.456 179.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 32.0 mmtt -58.46 134.49 56.71 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.045 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 30.5 mmm -122.15 100.56 7.03 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.48 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -174.81 145.15 0.85 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.008 0.432 . . . . 0.0 111.784 -179.659 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 tt -126.22 131.46 51.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.107 179.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.79 124.05 51.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.96 0.41 . . . . 0.0 111.959 -179.071 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.428 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.4 OUTLIER -92.91 143.53 26.16 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.973 178.753 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.436 HG13 ' HB2' ' A' ' 47' ' ' LYS . 1.1 mm -118.55 120.47 64.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.263 -179.625 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -88.79 147.01 19.57 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.068 179.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -59.38 135.35 57.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.9 0.381 . . . . 0.0 111.077 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.487 ' CG2' ' N ' ' A' ' 67' ' ' ASP . 1.8 p -77.88 161.13 4.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.415 0.626 . . . . 0.0 111.563 -179.809 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.487 ' N ' ' CG2' ' A' ' 66' ' ' VAL . 91.2 m-20 -90.77 77.51 6.26 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.627 179.628 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -63.56 -15.98 59.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.377 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 34.0 m -55.26 -21.98 16.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.808 0.337 . . . . 0.0 111.072 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.6 mmtp -78.81 -68.23 0.67 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.864 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.1 mttp 59.86 92.98 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.988 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.422 ' O ' ' N ' ' A' ' 80' ' ' VAL . 20.0 mtm-85 -93.49 -176.95 4.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.414 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -125.82 153.78 43.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.982 0.42 . . . . 0.0 111.165 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -87.03 168.39 13.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.816 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -58.47 -21.05 50.16 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.4 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -90.99 7.53 39.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.614 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.82 -11.91 68.97 Favored Glycine 0 C--N 1.332 0.339 0 C-N-CA 120.511 -0.852 . . . . 0.0 112.755 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -66.72 175.48 2.37 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.74 0.305 . . . . 0.0 110.829 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -96.66 163.76 12.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.924 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.422 ' N ' ' O ' ' A' ' 72' ' ' ARG . 22.1 t -135.72 157.78 39.16 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 CA-C-O 121.519 0.676 . . . . 0.0 111.869 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.6 t -124.73 97.89 38.06 Favored Pre-proline 0 C--N 1.32 -0.715 0 CA-C-N 114.819 -1.082 . . . . 0.0 108.354 177.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -45.05 166.24 0.05 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.253 1.969 . . . . 0.0 112.61 -178.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.507 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 1.1 mtmm -84.53 137.16 39.08 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 120.934 0.397 . . . . 0.0 110.958 -179.752 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.507 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 10.1 Cg_exo -76.23 165.78 28.87 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 123.367 2.711 . . . . 0.0 112.613 -179.119 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -65.5 156.1 33.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.534 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 66.7 mtm180 -148.68 133.25 17.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.82 0.343 . . . . 0.0 111.154 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.408 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 46.6 m-70 -116.31 159.03 22.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.503 179.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.3 ttt -125.69 142.1 51.68 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.996 0.427 . . . . 0.0 111.37 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.5 ' CE2' ' CD1' ' A' ' 9' ' ' PHE . 95.9 m-85 -152.02 125.81 9.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.514 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.3 t -101.61 143.02 32.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.989 0.423 . . . . 0.0 111.18 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.484 ' CG ' ' HG3' ' A' ' 97' ' ' MET . 54.2 m-85 -130.09 172.48 11.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.671 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 74.8 m-20 -132.36 23.38 4.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.184 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -154.08 116.43 4.34 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.832 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 9.0 mtt85 -57.73 -31.46 66.47 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.001 0.429 . . . . 0.0 110.751 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.03 -54.99 18.99 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.724 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 61.8 t -61.56 -37.55 78.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.186 179.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.484 ' HG3' ' CG ' ' A' ' 91' ' ' PHE . 1.4 ttp -69.3 -33.19 72.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.392 179.352 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.444 ' O ' ' HB3' ' A' ' 102' ' ' MET . 22.0 t70 -72.41 -25.13 61.37 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.146 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -80.98 -51.59 8.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.977 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.444 HD12 ' CG2' ' A' ' 16' ' ' ILE . 16.8 mm -53.83 -52.07 38.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.027 0.442 . . . . 0.0 110.782 179.695 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.59 -27.86 68.04 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.93 179.726 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.444 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.8 OUTLIER -78.78 -43.96 24.3 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.902 -179.972 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.424 HG23 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -69.84 -44.31 70.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.087 -179.546 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 16.2 mt -58.33 -38.96 78.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.832 0.349 . . . . 0.0 110.971 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -63.09 -28.72 70.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.961 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -68.49 -37.21 79.9 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.819 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.407 ' CD1' ' CD1' ' A' ' 42' ' ' LEU . 3.4 mt -68.68 -44.55 82.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.335 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.433 ' H ' HG13 ' A' ' 108' ' ' ILE . 2.1 mt -59.96 -61.02 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.618 0 CA-C-O 121.7 0.762 . . . . 0.0 109.319 179.024 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.5 t -50.6 -29.27 10.46 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.392 -1.276 . . . . 0.0 110.903 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 51.1 mtt180 -67.88 -33.81 75.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.079 0.466 . . . . 0.0 110.52 179.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -105.47 -0.97 25.45 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.911 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.839 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.5 t . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.814 0.34 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 76.2 m80 63.59 33.33 13.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.111 0.482 . . . . 0.0 111.14 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.578 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 64.2 p 178.25 171.83 0.71 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.841 179.139 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 155.78 119.15 0.63 Allowed Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.21 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.587 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -47.07 108.73 0.16 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.101 0.476 . . . . 0.0 111.404 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.461 ' CB ' ' CE2' ' A' ' 91' ' ' PHE . . . -123.7 153.18 41.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.81 -178.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.541 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.9 OUTLIER -99.72 124.36 53.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.976 0.417 . . . . 0.0 110.419 179.021 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.505 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 19.7 t80 -113.19 129.83 56.4 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.085 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.418 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 83.8 mt-10 57.08 34.46 24.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.894 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 29.2 mmtt 75.77 1.93 3.63 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.24 -179.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.521 ' O ' HG22 ' A' ' 8' ' ' ILE . 40.9 t -100.78 154.39 4.58 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.634 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.541 ' HA ' HG13 ' A' ' 8' ' ' ILE . 79.9 p -96.67 148.7 22.6 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-O 121.557 0.694 . . . . 0.0 112.517 -178.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.449 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.15 -179.74 46.22 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-N 114.649 -1.16 . . . . 0.0 110.404 -179.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.587 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.41 141.55 21.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 117.611 0.706 . . . . 0.0 110.602 179.378 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.578 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -106.75 118.57 54.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 179.53 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.462 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -119.8 139.83 51.72 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.19 -178.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.425 ' CD1' HG21 ' A' ' 103' ' ' THR . 94.1 mt -116.51 140.04 40.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.501 -178.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -125.56 111.37 14.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.7 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -94.21 7.88 43.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.244 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -80.43 -17.91 50.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.814 0.34 . . . . 0.0 110.346 179.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.49 ' CG2' ' N ' ' A' ' 23' ' ' SER . 0.6 OUTLIER -106.93 159.27 6.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.201 0.524 . . . . 0.0 111.227 -179.995 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.49 ' N ' ' CG2' ' A' ' 22' ' ' VAL . 7.1 m -131.27 121.54 18.61 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.811 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -76.51 137.58 49.85 Favored 'Cis proline' 0 C--N 1.348 0.504 0 C-N-CA 123.529 -1.446 . . . . 0.0 111.873 -0.063 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -44.74 140.8 2.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.679 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.405 ' CA ' HD22 ' A' ' 42' ' ' LEU . 77.5 mt-10 -127.36 158.48 37.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.324 0.583 . . . . 0.0 112.046 -178.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.449 ' O ' ' HA ' ' A' ' 39' ' ' THR . 4.2 tt -121.39 129.9 53.3 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.127 179.064 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.0 m -121.05 125.95 48.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.255 0.55 . . . . 0.0 112.334 -178.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.469 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 63.6 t90 -100.6 128.39 46.67 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.647 178.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 55.2 ttt-85 -125.59 118.16 25.12 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.863 0.363 . . . . 0.0 111.02 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.449 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 33.3 m -45.63 166.58 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.92 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.02 -41.68 67.26 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.47 0.652 . . . . 0.0 109.754 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -100.37 -9.84 21.83 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.852 -1.067 . . . . 0.0 111.209 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 91.73 26.86 18.68 Favored Glycine 0 C--N 1.331 0.299 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.391 -179.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -71.61 -24.02 61.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.742 0.306 . . . . 0.0 111.673 -179.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.51 153.87 19.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.08 0.467 . . . . 0.0 111.489 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.8 t -139.04 132.81 39.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.699 179.593 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.505 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 43.3 t60 -133.76 145.9 50.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.195 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.449 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 52.2 m -129.04 140.18 51.72 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.303 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 90.9 t -134.56 141.62 42.87 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.197 0 CA-C-O 121.152 0.501 . . . . 0.0 111.982 179.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -88.36 117.43 31.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.719 177.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.407 ' H ' ' CD2' ' A' ' 42' ' ' LEU . 0.1 OUTLIER -68.3 -19.87 64.72 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 120.784 0.326 . . . . 0.0 110.502 179.464 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 86.0 p -65.03 -28.28 69.38 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.07 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -86.71 -26.5 24.21 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.715 179.725 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 45.9 mm -57.24 91.31 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.036 -179.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -60.83 -30.58 70.19 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.035 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.618 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 35.4 mttt -152.36 157.44 41.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.927 0.394 . . . . 0.0 111.21 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.451 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -131.34 126.03 34.23 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.934 179.456 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -122.24 141.19 51.75 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.01 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.412 ' CB ' ' CD1' ' A' ' 60' ' ' LEU . . . -136.99 147.86 46.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.046 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 20.1 p -75.82 124.02 88.48 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.743 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.53 160.62 49.08 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.378 2.052 . . . . 0.0 112.408 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.68 -35.22 72.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.081 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.6 t -58.49 -25.84 62.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.005 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 32.7 t -98.57 115.01 27.68 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.822 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -58.26 -18.41 26.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.693 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.8 mtmm -71.45 97.37 1.63 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.985 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 12.0 mmm -82.1 108.27 15.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.765 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 1.3 tmm? -176.52 145.6 0.57 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.108 0.48 . . . . 0.0 111.742 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.474 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -115.69 159.99 20.65 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.938 179.354 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 7.3 tpt180 -145.86 127.72 15.4 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.466 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.56 144.17 32.69 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.316 179.126 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.618 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 2.4 mm -103.65 114.32 42.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.744 0.306 . . . . 0.0 111.416 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -79.32 129.19 8.99 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.106 179.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 20.6 mttt -52.03 148.14 6.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.939 0.4 . . . . 0.0 111.197 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.502 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 2.1 p -108.76 -162.34 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.876 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.502 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 5.7 t70 -156.7 71.49 0.69 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.97 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.0 mp0 -55.67 -21.56 18.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.466 -179.263 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.1 t -56.83 -19.68 18.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.084 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 32.3 mmtt -72.45 -47.67 47.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.978 0.418 . . . . 0.0 110.89 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.2 mmtt 62.85 94.7 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.923 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 15.0 mtt-85 -99.51 143.86 29.27 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.944 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.8 mmtp -87.48 145.66 26.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.005 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 43.6 p30 -97.44 177.6 5.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.107 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -60.99 -19.36 61.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.302 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -88.38 11.41 16.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.516 -179.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 68.67 17.62 71.24 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.708 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -117.09 146.24 43.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.94 0.4 . . . . 0.0 110.876 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -70.71 144.28 51.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.97 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.435 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.8 m -140.51 158.76 24.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.195 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 18.6 t -83.31 110.37 23.62 Favored Pre-proline 0 C--N 1.327 -0.378 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.435 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 71.7 Cg_exo -48.58 145.9 11.66 Favored 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 122.094 1.862 . . . . 0.0 112.668 -178.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.464 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 29.0 mttm -74.66 102.93 0.74 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.135 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.464 ' HD2' ' HA ' ' A' ' 83' ' ' LYS . 1.0 OUTLIER -40.17 149.38 0.14 Allowed 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 123.534 2.823 . . . . 0.0 112.642 179.275 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.36 155.15 36.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.771 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 55.6 mtt85 -153.49 119.83 5.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.68 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 84.4 m-70 -93.5 154.49 17.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.643 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.4 ttt -130.88 118.97 21.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.905 0.383 . . . . 0.0 111.484 -179.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.487 ' CE2' ' CD1' ' A' ' 9' ' ' PHE . 94.4 m-85 -127.73 125.47 40.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.215 179.478 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.98 131.44 44.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.995 0.426 . . . . 0.0 111.211 -179.538 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.474 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 12.1 m-85 -121.08 161.44 21.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.611 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -124.63 29.34 6.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.009 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 74.8 m-80 -156.6 112.32 2.94 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.795 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.71 -28.17 20.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.05 0.453 . . . . 0.0 111.044 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -77.43 -54.91 5.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.853 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 40.3 t -56.31 -44.76 80.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.87 -179.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -65.84 -35.97 82.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.115 179.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -66.64 -33.01 74.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.562 179.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.411 ' O ' ' HB ' ' A' ' 103' ' ' THR . 76.6 m-20 -63.49 -35.43 80.41 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.874 179.309 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.461 HG13 ' CE2' ' A' ' 91' ' ' PHE . 21.5 mm -71.07 -51.99 30.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.577 179.362 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 11.3 pttp -64.53 -27.23 68.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.614 179.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 44.1 mtm -78.21 -38.36 43.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.521 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.425 HG21 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -78.61 -38.11 40.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.611 179.728 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 12.0 mt -63.54 -40.36 96.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.592 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -62.99 -27.4 69.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.979 0.419 . . . . 0.0 111.04 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -70.41 -38.65 74.66 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.151 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.425 ' O ' ' HB2' ' A' ' 110' ' ' ARG . 60.8 mt -68.81 -46.68 79.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.543 -179.654 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.418 ' H ' HG13 ' A' ' 108' ' ' ILE . 2.6 mt -56.61 -60.17 2.22 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.621 0 CA-C-O 121.84 0.828 . . . . 0.0 109.507 179.187 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.7 m -48.78 -29.0 4.05 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.107 -1.406 . . . . 0.0 111.389 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.425 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 50.7 mtt-85 -70.82 -32.31 69.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.046 0.45 . . . . 0.0 110.809 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -95.6 -30.85 13.57 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.018 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.406 ' CD ' ' CG2' ' A' ' 108' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.577 179.709 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.3 t . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.778 0.323 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 59.3 m80 65.08 32.94 9.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.077 179.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.514 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 60.4 p -175.01 164.58 3.39 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.767 179.239 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 160.87 117.93 0.46 Allowed Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.383 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.58 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -47.06 110.46 0.3 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.085 0.469 . . . . 0.0 111.459 -179.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.449 ' O ' ' O ' ' A' ' 14' ' ' GLY . . . -125.61 150.78 47.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.632 -179.064 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.544 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -99.51 124.99 53.19 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-O 121.014 0.435 . . . . 0.0 110.443 179.332 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.515 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 7.1 t80 -112.93 130.73 56.01 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.163 179.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 55.88 34.28 23.25 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.944 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 78.7 mttt 76.11 1.5 3.45 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.274 -179.09 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.525 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.6 t -100.16 154.62 4.36 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.586 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.013 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.544 ' HA ' HG13 ' A' ' 8' ' ' ILE . 89.2 p -96.47 149.15 22.05 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.638 0.733 . . . . 0.0 112.785 -178.487 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.449 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 175.23 -179.77 46.27 Favored Glycine 0 N--CA 1.445 -0.705 0 CA-C-N 114.436 -1.256 . . . . 0.0 110.298 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.58 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.57 143.39 17.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 117.73 0.765 . . . . 0.0 110.438 179.352 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.514 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -106.75 118.3 54.22 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.682 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.625 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.464 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -121.64 133.82 54.98 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.345 -178.588 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.433 ' CD1' HG21 ' A' ' 103' ' ' THR . 90.6 mt -106.33 140.1 25.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.184 -179.028 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -131.99 111.4 11.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.904 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -89.77 6.26 42.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.312 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -79.02 -18.05 54.25 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.906 0.384 . . . . 0.0 110.398 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -98.98 144.25 12.11 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.09 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.9 t -116.47 116.32 39.2 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.755 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.404 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 1.8 Cg_endo -80.01 143.8 67.41 Favored 'Cis proline' 0 C--N 1.349 0.562 0 C-N-CA 123.819 -1.326 . . . . 0.0 111.883 -0.05 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.56 140.68 4.19 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.884 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -134.25 167.21 21.12 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.251 0.548 . . . . 0.0 111.746 -179.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.0 tt -121.18 128.17 52.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.674 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.3 m -115.72 128.55 55.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.174 0.511 . . . . 0.0 112.339 -178.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.465 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 57.2 t90 -100.53 130.1 46.56 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.461 -0.791 . . . . 0.0 109.714 178.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 17.0 ttt180 -124.45 115.72 21.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.831 0.348 . . . . 0.0 110.947 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.421 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 3.8 p -45.45 166.38 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.109 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.65 -42.0 59.32 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 121.416 0.627 . . . . 0.0 109.792 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 48.7 p30 -81.94 -19.44 40.7 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.313 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.89 33.88 11.89 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.271 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -108.54 -21.37 12.75 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.731 0.271 . . . . 0.0 111.731 -179.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.27 134.52 48.96 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.885 0.374 . . . . 0.0 111.103 -179.793 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 12.2 p -139.3 137.79 40.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.063 179.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.515 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 56.5 t60 -136.97 146.05 44.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.144 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 46.9 m -127.82 134.03 49.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.172 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.7 t -124.33 140.8 46.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.367 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.465 ' CG1' HG23 ' A' ' 44' ' ' THR . 2.0 p -85.3 117.61 30.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.12 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.41 ' HA ' HG12 ' A' ' 45' ' ' ILE . 83.5 mt -75.38 -29.67 59.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.982 -178.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.416 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 10.9 t -55.49 -22.16 19.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.867 -179.2 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.465 HG23 ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -95.49 -22.14 17.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.719 0.295 . . . . 0.0 111.195 -179.896 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.41 HG12 ' HA ' ' A' ' 42' ' ' LEU . 36.7 mm -57.11 89.3 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.886 -179.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -74.32 -27.88 60.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.506 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.693 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 28.6 mtpt -141.13 146.04 36.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.132 0.492 . . . . 0.0 111.769 -179.289 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.455 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -132.33 124.95 29.8 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.607 179.301 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -127.28 145.05 50.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.943 0.401 . . . . 0.0 111.552 -178.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -133.2 156.98 46.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.836 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 46.5 p -75.74 133.52 73.26 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.528 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.7 154.98 51.24 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.631 2.221 . . . . 0.0 112.557 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.33 -42.98 99.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.155 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.4 m -58.34 -27.53 64.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.09 0.472 . . . . 0.0 110.737 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 29.4 t -81.99 119.85 24.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.811 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -56.84 -18.44 13.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.438 179.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.6 mmtm -61.01 149.38 36.99 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.944 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.404 ' CE ' ' N ' ' A' ' 93' ' ' ASN . 15.6 mmm -133.78 79.98 1.85 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.672 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.416 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.6 OUTLIER -147.62 169.11 20.34 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.06 0.457 . . . . 0.0 112.037 -179.541 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.69 131.13 19.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.872 179.47 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -113.48 132.34 55.7 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.043 0.449 . . . . 0.0 112.211 -178.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.468 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -110.48 140.64 44.55 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.229 179.246 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.693 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.2 mm -111.82 127.33 69.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.772 0.32 . . . . 0.0 111.328 179.72 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.56 129.66 9.98 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.217 179.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.6 mttt -44.35 145.63 0.79 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.833 0.349 . . . . 0.0 111.413 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.432 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.2 p -117.73 -162.05 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.815 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.432 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 7.3 t0 -178.81 50.44 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.503 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -57.59 -22.5 45.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.334 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 23.7 t -62.1 -16.11 50.04 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.944 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.1 mttt -69.7 -39.95 76.6 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.094 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.8 mtmt 60.43 90.96 0.06 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.813 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 74.3 mmt-85 -94.4 143.88 26.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.022 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 45.4 mmtt -88.14 145.86 25.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.905 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -94.49 173.21 7.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.894 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -60.33 -20.03 57.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.23 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -86.64 4.79 38.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.426 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.3 15.22 81.73 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.606 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -111.72 144.69 40.6 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.812 0.339 . . . . 0.0 110.99 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -71.76 148.01 46.75 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.044 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.425 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 1.5 m -131.01 158.82 43.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.95 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 38.9 t -103.64 98.58 13.18 Favored Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.749 178.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.425 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 86.8 Cg_exo -46.2 162.61 0.12 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.411 2.074 . . . . 0.0 112.419 -179.106 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.486 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -117.8 143.79 33.19 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.745 179.928 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 15.2 Cg_exo -73.47 148.29 42.55 Favored 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 123.453 2.768 . . . . 0.0 112.695 -179.087 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -76.61 147.88 37.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.759 179.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.8 mtp180 -150.93 121.84 7.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.959 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -110.17 146.99 34.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.627 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -129.61 135.73 48.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.31 -179.723 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.496 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 97.7 m-85 -135.6 153.98 51.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.811 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.416 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.4 OUTLIER -126.55 123.89 38.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.912 0.387 . . . . 0.0 110.871 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.473 ' CD1' ' N ' ' A' ' 91' ' ' PHE . 2.2 m-85 -112.87 172.74 6.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.808 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 23.6 p30 -124.69 26.35 7.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.218 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.404 ' N ' ' CE ' ' A' ' 58' ' ' MET . 80.4 m-20 -158.07 122.02 4.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.97 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -56.91 -35.18 68.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.191 0.519 . . . . 0.0 110.693 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.34 -50.26 60.71 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.014 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 52.4 t -59.48 -39.5 79.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.535 179.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.463 ' HG3' ' CG ' ' A' ' 91' ' ' PHE . 2.0 mtp -65.84 -36.58 83.86 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.525 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -68.96 -34.52 75.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.837 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.401 ' O ' ' HB ' ' A' ' 103' ' ' THR . 62.9 m-20 -61.5 -42.65 99.12 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.255 179.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.456 HG13 ' CE2' ' A' ' 91' ' ' PHE . 23.9 mm -66.49 -51.44 57.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.543 179.422 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.52 -27.2 68.29 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.646 179.626 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.1 mmm -78.19 -37.5 45.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.445 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.433 HG21 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -80.69 -36.8 31.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.666 179.761 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 13.0 mt -63.64 -41.48 98.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.758 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -62.42 -28.46 69.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.022 179.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -69.53 -32.76 71.78 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.035 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.403 ' CD1' ' CD1' ' A' ' 42' ' ' LEU . 5.6 mt -75.11 -45.2 42.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.38 -179.675 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.416 ' H ' HG13 ' A' ' 108' ' ' ILE . 1.9 mt -58.32 -61.13 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.556 0 CA-C-O 121.769 0.795 . . . . 0.0 109.428 179.282 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.4 m -50.72 -28.72 9.69 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.376 -1.284 . . . . 0.0 110.637 179.24 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.3 ttm180 -70.11 -48.31 58.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.263 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.416 ' CE2' ' HA ' ' A' ' 43' ' ' SER . 26.6 m-85 -74.44 -29.09 61.34 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.415 179.66 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 2.2 mttt . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.587 179.879 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.9 t . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.899 0.381 . . . . 0.0 110.912 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.426 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 48.3 m80 -115.05 34.52 4.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.196 0.522 . . . . 0.0 110.93 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.489 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 19.2 p -171.29 141.91 1.65 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.59 179.154 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -172.54 118.19 0.7 Allowed Glycine 0 N--CA 1.446 -0.683 0 C-N-CA 120.531 -0.842 . . . . 0.0 112.429 179.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.593 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -45.68 103.25 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.122 0.487 . . . . 0.0 111.375 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.464 ' O ' ' O ' ' A' ' 14' ' ' GLY . . . -119.4 153.78 34.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.813 -178.914 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.533 HG22 ' O ' ' A' ' 12' ' ' VAL . 1.0 OUTLIER -99.98 126.59 53.43 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.255 0 CA-C-O 121.076 0.465 . . . . 0.0 110.372 178.968 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.505 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 22.2 t80 -114.68 128.12 56.14 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.03 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.417 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 82.8 mt-10 58.02 37.87 26.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.684 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 10' ' ' GLU . 2.3 mmtt 72.01 2.94 4.5 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.567 -179.153 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.533 ' O ' HG22 ' A' ' 8' ' ' ILE . 39.6 t -101.83 155.19 4.84 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.582 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 178.78 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.53 ' HA ' HG13 ' A' ' 8' ' ' ILE . 96.4 p -96.57 149.07 22.18 Favored 'General case' 0 C--N 1.313 -1.022 0 CA-C-O 121.594 0.712 . . . . 0.0 112.617 -178.557 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.464 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 175.64 -179.59 46.73 Favored Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 114.603 -1.18 . . . . 0.0 110.347 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.593 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.62 141.97 20.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 117.732 0.766 . . . . 0.0 110.53 179.413 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.489 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -106.68 118.38 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 179.551 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -119.64 135.0 54.99 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.353 -178.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.437 ' CD1' HG23 ' A' ' 103' ' ' THR . 69.6 mt -107.16 140.12 26.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.597 -0.728 . . . . 0.0 111.171 -179.01 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 70.0 m-20 -132.08 113.25 13.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.925 -179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -90.83 6.11 45.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.169 179.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 86.3 m-20 -79.48 -17.68 53.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.004 0.431 . . . . 0.0 110.478 179.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.68 143.77 13.15 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.985 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.8 t -116.94 116.16 38.21 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.867 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.403 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 2.0 Cg_endo -79.82 144.0 68.92 Favored 'Cis proline' 0 C--N 1.348 0.529 0 C-N-CA 123.782 -1.341 . . . . 0.0 111.954 0.049 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -45.68 140.68 3.27 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.014 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 68.5 mt-10 -133.62 167.11 21.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.247 0.546 . . . . 0.0 111.654 -179.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.3 tt -121.18 131.81 54.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.713 179.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.4 m -118.32 126.98 53.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.072 0.463 . . . . 0.0 112.093 -178.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.482 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 60.0 t90 -100.52 130.2 46.56 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.974 179.13 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 8.3 ttt85 -125.28 115.8 20.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.799 0.333 . . . . 0.0 110.912 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.423 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 29.5 t -45.49 166.54 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.142 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.07 -42.08 60.74 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.38 0.61 . . . . 0.0 109.663 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 89.7 m-20 -80.07 -22.72 41.94 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.126 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.57 32.96 10.67 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.469 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -108.31 -19.26 13.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.612 0.244 . . . . 0.0 111.471 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.96 134.95 49.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.791 0.329 . . . . 0.0 111.085 -179.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 11.8 p -138.98 139.09 41.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.11 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.505 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 65.9 t60 -135.82 146.14 47.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.124 0.488 . . . . 0.0 111.253 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 42.0 m -127.52 135.13 49.93 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.846 179.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 99.4 t -130.77 140.82 47.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.012 0.434 . . . . 0.0 111.601 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.453 ' CG1' ' CG2' ' A' ' 44' ' ' THR . 1.4 p -84.98 117.8 30.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 178.121 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.461 ' HA ' HG12 ' A' ' 45' ' ' ILE . 45.3 mt -75.44 -30.14 59.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.969 -178.622 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.413 ' HB2' ' CZ ' ' A' ' 111' ' ' TYR . 11.7 t -55.27 -21.7 15.47 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.096 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.453 ' CG2' ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -89.37 -22.97 22.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.795 0.331 . . . . 0.0 111.213 -179.7 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.461 HG12 ' HA ' ' A' ' 42' ' ' LEU . 48.3 mm -48.41 106.49 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.953 0.406 . . . . 0.0 111.206 -179.618 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -99.46 -20.09 16.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.404 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.409 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 51.2 mttp -154.53 133.01 11.99 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.961 0.41 . . . . 0.0 111.419 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 87.4 mt -107.7 124.36 49.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.664 179.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -113.78 134.95 54.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.633 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -142.34 144.99 33.45 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.882 0.372 . . . . 0.0 111.19 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.403 ' CG2' ' CE ' ' A' ' 57' ' ' LYS . 72.9 p -75.87 129.99 79.72 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.765 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.5 154.31 74.78 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.538 2.159 . . . . 0.0 112.371 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.95 -34.53 74.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.125 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.1 m -59.08 -27.63 65.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.008 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 71.4 m -82.64 120.29 25.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.965 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -58.5 -17.74 23.56 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.525 179.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.403 ' CE ' ' CG2' ' A' ' 51' ' ' THR . 0.0 OUTLIER -84.61 148.2 26.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.184 -179.852 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 17.5 mmm -119.45 128.35 53.92 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.683 -179.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.466 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.6 OUTLIER -179.88 165.25 1.24 Allowed 'General case' 0 N--CA 1.462 0.136 0 CA-C-O 121.251 0.548 . . . . 0.0 112.331 179.771 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.2 tt -148.48 137.3 21.6 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.305 -0.862 . . . . 0.0 109.776 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.35 126.72 47.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.985 0.421 . . . . 0.0 112.008 -179.186 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.437 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -99.74 139.65 35.08 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.015 179.038 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.409 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 1.0 OUTLIER -118.67 127.89 75.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.164 -179.761 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -95.78 156.79 21.55 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.237 179.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.4 mttp -58.3 157.9 7.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.81 0.338 . . . . 0.0 111.0 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.448 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.2 p -121.86 -162.1 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.966 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.448 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 54.1 t0 -172.04 61.88 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.278 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -58.23 -20.79 44.59 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.245 -179.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 37.9 m -57.7 -19.08 24.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.087 179.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -61.68 -47.08 86.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.988 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp 62.64 95.31 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.819 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 42.9 mmt180 -103.18 165.44 11.02 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.816 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -125.55 145.3 50.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.979 0.419 . . . . 0.0 111.103 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -85.22 173.01 10.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.872 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.75 -17.76 61.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.291 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -87.65 6.99 31.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.45 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 81.73 -1.35 86.43 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.596 -0.812 . . . . 0.0 112.751 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -84.0 159.49 21.21 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.732 0.301 . . . . 0.0 110.765 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -95.95 147.6 23.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.864 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.427 ' CG2' ' N ' ' A' ' 81' ' ' VAL . 0.2 OUTLIER -140.56 152.66 21.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.597 0.713 . . . . 0.0 111.255 -179.997 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.43 HG11 ' O ' ' A' ' 81' ' ' VAL . 5.7 p -103.24 100.1 16.74 Favored Pre-proline 0 C--N 1.32 -0.708 0 CA-C-N 114.487 -1.233 . . . . 0.0 110.634 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -46.8 145.27 6.99 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.409 2.073 . . . . 0.0 112.509 -179.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -91.42 151.01 42.28 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.047 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -72.49 161.09 45.14 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 123.466 2.777 . . . . 0.0 112.716 -178.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -65.36 138.1 57.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.749 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.2 mtp-105 -139.81 119.89 13.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.906 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -110.22 157.44 19.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.725 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 3.1 ttt -127.34 140.55 52.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.95 0.405 . . . . 0.0 111.337 -179.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.446 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 97.9 m-85 -150.69 127.77 11.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.572 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.466 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 14.4 t -107.21 132.48 53.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.906 0.384 . . . . 0.0 111.326 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.462 ' CE2' ' CB ' ' A' ' 7' ' ' ALA . 3.4 m-85 -122.29 172.32 8.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.646 179.615 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -128.67 26.21 5.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.966 179.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -152.94 119.64 5.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.524 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -55.13 -34.0 63.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.017 0.437 . . . . 0.0 110.937 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.06 -55.29 6.71 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.124 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 48.1 t -60.02 -41.15 85.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.969 0.414 . . . . 0.0 110.198 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.412 ' HG3' ' CD1' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -67.76 -37.15 81.72 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.529 179.632 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -76.09 -31.3 58.66 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.967 0.413 . . . . 0.0 111.039 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -59.53 -41.35 89.81 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.379 179.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.432 HG13 ' CE2' ' A' ' 91' ' ' PHE . 24.5 mm -65.66 -51.89 57.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.504 179.424 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.4 ' HG3' ' N ' ' A' ' 102' ' ' MET . 0.1 OUTLIER -65.32 -27.13 68.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.476 179.516 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.4 ' N ' ' HG3' ' A' ' 101' ' ' LYS . 43.4 mtm -78.43 -40.28 36.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.708 179.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.437 HG23 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -76.59 -38.83 54.21 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.63 179.846 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.404 ' CD2' ' CD2' ' A' ' 42' ' ' LEU . 6.5 mt -61.19 -38.98 88.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.572 179.735 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.0 -32.33 69.61 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.043 0.449 . . . . 0.0 110.427 179.454 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -66.44 -31.24 71.87 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.056 179.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 10.0 mm -69.22 -56.7 10.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.579 179.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . . . . . . . . . 2.2 mt -50.66 -61.08 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.542 0 CA-C-O 121.783 0.801 . . . . 0.0 109.662 179.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.2 m -51.66 -28.9 15.94 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 114.235 -1.348 . . . . 0.0 110.674 179.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 4.1 mtt-85 -67.33 -40.44 85.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.41 179.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.413 ' CZ ' ' HB2' ' A' ' 43' ' ' SER . 86.5 m-85 -84.35 -28.28 27.14 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.382 179.489 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 20.2 mttt . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.497 179.258 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . 0.401 ' CB ' ' ND2' ' A' ' 99' ' ' ASN . 11.8 Cg_endo . . . . . 0 N--CA 1.477 0.519 0 CA-C-O 120.909 0.295 . . . . 0.0 111.806 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.3 m -143.26 128.04 18.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.873 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 35.4 m80 63.29 33.58 13.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.287 0.565 . . . . 0.0 111.08 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.527 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 54.9 p 177.59 129.28 0.05 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.637 179.189 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -164.04 114.47 0.6 Allowed Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.598 -0.811 . . . . 0.0 112.335 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.594 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -43.7 100.57 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.165 0.507 . . . . 0.0 111.436 -179.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.476 ' O ' ' O ' ' A' ' 14' ' ' GLY . . . -116.54 154.71 29.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.909 -178.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.547 HG23 ' O ' ' A' ' 12' ' ' VAL . 1.0 OUTLIER -101.78 126.63 55.69 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 CA-C-O 121.105 0.479 . . . . 0.0 110.443 178.967 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.499 ' CD1' ' CE2' ' A' ' 89' ' ' PHE . 15.4 t80 -114.0 130.67 56.53 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.208 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.422 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 37.4 mt-10 55.73 35.08 24.63 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.024 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 28.2 mttm 76.24 1.28 3.39 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.394 -179.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.547 ' O ' HG23 ' A' ' 8' ' ' ILE . 42.1 t -99.6 156.68 3.94 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.644 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 178.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.526 ' HA ' HG13 ' A' ' 8' ' ' ILE . 91.1 p -98.86 149.68 22.66 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-O 121.435 0.636 . . . . 0.0 112.408 -178.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.476 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 174.53 -179.53 45.79 Favored Glycine 0 N--CA 1.447 -0.624 0 N-CA-C 110.281 -1.128 . . . . 0.0 110.281 -179.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.594 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.45 142.49 19.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 117.719 0.76 . . . . 0.0 110.493 179.368 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.527 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -106.63 118.29 54.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 179.784 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -120.19 136.83 54.5 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.17 0.51 . . . . 0.0 111.533 -178.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.424 ' CD1' HG22 ' A' ' 103' ' ' THR . 88.5 mt -109.95 140.03 30.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.095 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.8 t-20 -131.29 111.56 11.99 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.915 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -91.54 6.64 44.85 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.275 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 50.8 t0 -79.56 -17.99 52.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.921 0.391 . . . . 0.0 110.333 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -102.78 144.17 14.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.903 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 70.3 m -116.15 118.89 37.5 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.969 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.405 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 1.8 Cg_endo -80.84 137.88 40.98 Favored 'Cis proline' 0 C--N 1.348 0.519 0 C-N-CA 123.768 -1.347 . . . . 0.0 111.891 -0.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -42.95 140.61 1.33 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.068 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -132.46 167.06 20.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.213 0.53 . . . . 0.0 111.81 -179.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.2 tt -121.11 131.18 54.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.788 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 45.2 m -118.75 126.27 51.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.062 0.458 . . . . 0.0 112.047 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.479 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 62.2 t90 -100.43 128.14 46.57 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.814 178.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.02 118.8 27.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.841 0.353 . . . . 0.0 111.062 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 30.7 t -45.44 167.18 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.314 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.3 -42.78 53.95 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.491 0.662 . . . . 0.0 109.748 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -85.22 -17.83 35.88 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.91 -1.041 . . . . 0.0 111.109 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.74 33.9 12.25 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.359 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -98.83 -22.08 16.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.625 0.25 . . . . 0.0 111.568 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.12 144.11 40.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.989 0.423 . . . . 0.0 111.379 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 42.4 t -139.23 144.06 29.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.758 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.493 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 49.3 t60 -137.27 145.95 44.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.03 0.443 . . . . 0.0 111.415 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.2 m -128.77 137.87 51.78 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.797 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 88.5 t -135.98 140.86 43.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.997 0.427 . . . . 0.0 111.663 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.453 ' CG1' ' CG2' ' A' ' 44' ' ' THR . 1.7 p -83.25 117.36 28.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 177.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.489 ' HA ' HG12 ' A' ' 45' ' ' ILE . 85.8 mt -75.63 -34.27 60.55 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.162 -0.472 . . . . 0.0 112.187 -178.612 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.405 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 22.4 t -51.07 -24.62 4.07 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.031 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.453 ' CG2' ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -85.81 -23.7 27.09 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.816 0.341 . . . . 0.0 111.142 -179.693 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.489 HG12 ' HA ' ' A' ' 42' ' ' LEU . 41.9 mm -47.27 101.5 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.314 -179.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -95.25 -20.7 18.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.444 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.495 ' HB2' HG13 ' A' ' 63' ' ' ILE . 46.1 mtmt -153.33 138.58 17.47 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.939 0.399 . . . . 0.0 111.286 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.415 ' CD1' HD12 ' A' ' 108' ' ' ILE . 34.1 mt -109.59 124.35 50.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.899 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -109.91 130.48 55.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.398 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.401 ' CB ' ' CE ' ' A' ' 101' ' ' LYS . . . -145.81 138.95 26.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.097 -179.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 70.0 p -75.76 133.66 73.03 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.549 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.39 149.94 78.2 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.593 2.196 . . . . 0.0 112.443 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.02 -41.68 97.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.142 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 87.3 p -59.29 -26.17 64.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.867 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.9 t -87.73 118.91 27.55 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.874 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -57.7 -18.45 20.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.389 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 30.3 mmtt -65.51 110.07 2.57 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.995 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 19.0 mmm -94.49 123.9 38.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.44 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.437 ' CE ' ' CE3' ' B' ' 53' ' ' TRP . 11.5 ttm -177.18 160.42 1.73 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.224 0.535 . . . . 0.0 111.994 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.401 HD22 ' CE1' ' A' ' 91' ' ' PHE . 6.3 tp -148.46 123.91 10.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.86 179.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 33.0 mtt180 -116.47 136.68 52.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.141 0.496 . . . . 0.0 112.039 -178.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.424 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -111.55 131.0 55.55 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.884 179.02 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.495 HG13 ' HB2' ' A' ' 47' ' ' LYS . 1.0 OUTLIER -109.07 122.14 63.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.128 -179.365 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.58 145.96 17.89 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.354 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.9 mttt -58.62 158.82 7.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.854 0.359 . . . . 0.0 110.959 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.433 ' CG1' ' N ' ' A' ' 67' ' ' ASP . 1.1 p -121.55 -162.13 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.894 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.433 ' N ' ' CG1' ' A' ' 66' ' ' VAL . 5.3 m-20 -175.99 55.41 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.33 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -58.3 -21.55 49.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.279 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 35.6 m -59.58 -17.96 37.06 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.061 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -69.05 -38.75 79.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.043 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.3 mptt 59.62 92.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.819 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 43.0 mmt180 -95.2 140.87 29.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.991 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 26.1 mmtp -87.6 145.64 26.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.986 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -93.43 172.51 8.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.887 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -60.07 -19.98 55.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.328 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 51.2 mp0 -86.41 4.63 38.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.422 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.62 14.36 82.52 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.699 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -110.45 144.73 38.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.912 0.387 . . . . 0.0 110.948 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -70.96 148.97 47.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.105 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.436 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.1 m -132.21 158.83 43.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.932 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.5 t -102.66 98.62 11.43 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.671 178.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.436 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 85.0 Cg_exo -45.61 161.66 0.12 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.428 2.085 . . . . 0.0 112.546 -179.095 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -115.0 150.47 44.25 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.054 0.454 . . . . 0.0 110.978 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -72.56 147.41 45.87 Favored 'Trans proline' 0 N--CA 1.465 -0.164 0 C-N-CA 123.466 2.777 . . . . 0.0 112.728 -179.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -72.5 142.36 48.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.796 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 87.0 mtt180 -150.68 119.95 6.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.853 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -105.7 159.06 16.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.671 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.0 ttt -131.74 121.43 24.2 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.929 0.395 . . . . 0.0 111.33 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.499 ' CE2' ' CD1' ' A' ' 9' ' ' PHE . 91.8 m-85 -128.67 154.0 46.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.505 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 33.1 t -126.68 134.13 50.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.951 0.405 . . . . 0.0 111.141 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.475 ' CG ' ' HB3' ' A' ' 97' ' ' MET . 83.3 m-85 -120.37 162.07 20.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.48 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -109.43 -21.28 12.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.214 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -116.51 112.6 21.61 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.658 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -48.06 -29.38 3.5 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.02 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.5 -48.92 63.16 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.119 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 52.6 t -58.79 -52.73 56.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.416 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.475 ' HB3' ' CG ' ' A' ' 91' ' ' PHE . 4.0 ptm -62.91 -32.11 73.32 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.446 ' O ' ' HB3' ' A' ' 102' ' ' MET . 12.0 m-20 -63.63 -34.2 77.32 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.182 179.284 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.401 ' ND2' ' CB ' ' A' ' 1' ' ' PRO . 83.5 m-20 -72.05 -44.18 63.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.483 179.473 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.443 HG13 ' CZ ' ' A' ' 91' ' ' PHE . 23.4 mm -60.14 -50.52 79.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.568 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.401 ' CE ' ' CB ' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -61.7 -30.92 71.06 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.939 179.855 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.446 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.1 OUTLIER -79.09 -43.72 23.55 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.506 179.83 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.424 HG22 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -67.47 -42.69 82.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.849 -179.801 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 35.9 mt -61.7 -39.49 91.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.556 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -60.86 -32.26 71.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.686 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -68.56 -29.48 68.05 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.812 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.402 ' CD1' ' CD1' ' A' ' 42' ' ' LEU . 23.4 mt -77.25 -50.44 20.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.319 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.451 ' H ' HG13 ' A' ' 108' ' ' ILE . 2.3 mt -56.58 -61.1 1.32 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.622 0 CA-C-O 121.749 0.785 . . . . 0.0 109.268 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.6 t -50.56 -28.83 9.37 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.394 -1.275 . . . . 0.0 110.574 179.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 2.2 mtt180 -65.66 -39.83 91.8 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.663 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -85.9 -30.05 23.16 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.592 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -63.85 -45.24 90.38 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.465 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -59.86 -37.02 78.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.93 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.06 -33.95 76.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.145 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 22.8 t70 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.865 -179.961 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.8 0.334 . . . . 0.0 111.164 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.7 m -121.39 161.43 41.27 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.927 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_exo -51.95 -41.42 63.77 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.59 2.193 . . . . 0.0 112.372 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -56.91 -28.12 61.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.984 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -63.64 -47.73 80.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.771 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 40.0 mm -68.62 -27.48 36.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.19 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -65.88 -32.78 74.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.778 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -30.66 69.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.927 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' TRP . . . . . 0.437 ' CE3' ' CE ' ' A' ' 59' ' ' MET . 11.7 m95 -55.71 -32.51 63.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.834 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -82.08 -28.15 32.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.974 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -77.58 -44.96 26.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.777 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 44.5 -166.21 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.462 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -139.81 138.79 20.35 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.792 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo . . . . . 0 C--O 1.25 1.076 0 C-N-CA 122.427 2.084 . . . . 0.0 112.259 -179.965 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo . . . . . 0 N--CA 1.475 0.434 0 CA-C-O 120.777 0.24 . . . . 0.0 111.807 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.0 m -177.68 -39.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.972 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.401 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 58.8 m80 -134.93 35.46 3.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.169 0.509 . . . . 0.0 110.927 -179.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.532 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 58.7 p -178.61 114.96 0.07 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.919 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.424 ' O ' ' C ' ' A' ' 6' ' ' ALA . . . -146.2 113.24 0.67 Allowed Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.946 -0.645 . . . . 0.0 111.978 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.517 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -32.71 121.13 0.34 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.741 0.305 . . . . 0.0 111.327 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.476 ' HB1' ' HB ' ' A' ' 16' ' ' ILE . . . -137.35 149.96 47.38 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -178.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.558 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.2 mp -98.14 124.31 51.14 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.306 0 CA-C-O 121.119 0.485 . . . . 0.0 110.408 179.189 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.502 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 14.7 t80 -115.85 130.6 56.9 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.069 179.617 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 58.27 33.71 23.4 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.824 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.1 mttm 75.64 1.34 3.57 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.084 -178.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.497 ' O ' HG22 ' A' ' 8' ' ' ILE . 31.3 t -100.8 149.76 6.04 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.728 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.558 ' HA ' HG13 ' A' ' 8' ' ' ILE . 66.7 p -88.25 145.94 25.6 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.548 -179.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.433 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -175.54 -179.24 45.95 Favored Glycine 0 N--CA 1.442 -0.93 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.668 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.517 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 8.0 mm -106.69 136.32 41.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 CA-C-O 120.792 0.329 . . . . 0.0 110.138 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.532 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.2 OUTLIER -106.63 117.81 53.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 178.939 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.466 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -124.18 125.5 44.55 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.239 0.542 . . . . 0.0 111.551 -178.076 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.474 ' CD1' HG23 ' A' ' 103' ' ' THR . 33.7 mt -94.55 139.97 17.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.809 -179.567 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -131.41 113.76 14.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.031 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -91.01 5.47 48.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.239 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -78.59 -17.96 55.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.937 0.399 . . . . 0.0 110.428 179.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.33 143.96 12.7 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.824 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.4 t -119.61 116.15 33.44 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.966 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.489 ' HG2' HG21 ' A' ' 41' ' ' VAL . 72.1 Cg_endo -77.39 148.41 87.08 Favored 'Cis proline' 0 C--N 1.348 0.544 0 C-N-CA 123.258 -1.559 . . . . 0.0 112.29 -0.098 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.56 139.37 7.02 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.793 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -130.66 166.98 19.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.192 0.52 . . . . 0.0 111.577 -179.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.8 tt -121.16 128.61 52.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.824 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.7 m -116.08 127.2 54.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.065 0.46 . . . . 0.0 111.821 -179.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.484 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 55.3 t90 -100.45 125.15 46.71 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.108 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 14.6 tpt180 -120.92 116.65 25.53 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.589 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 26.3 t -44.54 156.8 0.07 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.675 0.274 . . . . 0.0 110.879 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.433 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -65.94 -39.42 90.48 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 121.586 0.708 . . . . 0.0 109.305 179.866 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -88.16 -20.01 26.18 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.603 -1.18 . . . . 0.0 111.091 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.58 33.48 11.41 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.483 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -97.59 -22.31 16.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.704 0.288 . . . . 0.0 111.525 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.94 145.01 43.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.208 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 38.8 t -139.14 140.0 38.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.185 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.502 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 45.9 t60 -139.61 145.84 39.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.401 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 52.4 m -129.02 138.44 51.92 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.97 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 85.4 t -132.61 140.91 46.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 121.151 0.5 . . . . 0.0 111.846 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.489 HG21 ' HG2' ' A' ' 24' ' ' PRO . 2.1 p -87.42 118.12 32.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.166 178.027 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.434 ' HA ' HG12 ' A' ' 45' ' ' ILE . 84.3 mt -74.92 -31.77 61.63 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -178.305 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.444 ' CB ' ' HB2' ' A' ' 24' ' ' PRO . 3.2 t -53.74 -24.66 15.62 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.478 HG21 ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -92.0 -22.41 19.99 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.806 0.336 . . . . 0.0 111.13 -179.791 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.458 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 46.4 mm -56.2 91.91 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.11 0.481 . . . . 0.0 110.844 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -63.36 -29.55 70.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.394 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.627 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 0.3 OUTLIER -153.99 157.41 39.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.09 0.471 . . . . 0.0 111.587 -179.751 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -128.34 127.59 42.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.544 179.138 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -115.99 141.27 48.34 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.006 0.432 . . . . 0.0 111.548 -179.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -148.12 135.36 20.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.699 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.41 HG23 ' CE2' ' B' ' 54' ' ' PHE . 68.7 p -75.79 131.49 76.48 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.823 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -69.25 160.66 48.97 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.527 2.152 . . . . 0.0 112.404 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.9 -40.56 73.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.159 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 86.0 p -62.75 -26.79 68.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.816 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 41.2 t -75.74 121.7 22.92 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.92 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -56.25 -18.69 11.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.273 179.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.04 154.48 35.65 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.717 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.434 ' HE1' ' HA ' ' A' ' 92' ' ' ASN . 63.6 mtp -143.07 79.75 1.66 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.916 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.471 ' HE3' ' CE3' ' B' ' 53' ' ' TRP . 2.4 mpp? -155.24 169.1 24.97 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.049 0.452 . . . . 0.0 111.446 -179.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.43 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.2 OUTLIER -132.36 124.24 28.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.989 179.33 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.6 mmt180 -107.83 121.95 45.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.954 0.407 . . . . 0.0 111.846 -179.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.434 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -102.7 134.8 45.49 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.141 178.968 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.627 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.3 mm -99.95 150.13 5.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.532 -0.303 . . . . 0.0 111.069 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -115.62 134.28 11.42 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.206 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 25.7 mttt -53.78 139.52 32.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.852 0.358 . . . . 0.0 111.066 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.455 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.4 p -113.3 -161.92 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.956 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.455 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 0.2 OUTLIER -176.97 67.79 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.141 179.923 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 50.8 mp0 -58.31 -20.87 46.46 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.426 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 27.0 t -58.97 -17.98 29.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.176 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 52.7 mmtt -62.41 -44.02 97.43 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.777 0.323 . . . . 0.0 111.142 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 60.38 92.99 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.774 -179.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 14.1 mtt-85 -106.55 150.6 25.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.989 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.9 mmtt -96.64 149.05 22.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.91 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -96.58 171.66 8.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.866 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -59.68 -20.19 54.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.283 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -86.76 5.96 33.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.389 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.12 15.92 81.06 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.573 -0.823 . . . . 0.0 112.638 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -111.91 145.26 39.85 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.9 0.381 . . . . 0.0 110.943 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -74.04 145.74 44.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.942 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.455 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.2 m -130.53 158.92 42.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.062 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 19.0 t -101.62 98.66 9.9 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.698 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.455 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 80.8 Cg_exo -44.59 145.41 2.69 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.369 2.046 . . . . 0.0 112.651 -179.083 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.447 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 13.1 mtmt -100.67 148.54 35.14 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.953 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 16.8 Cg_exo -72.41 150.52 52.34 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 123.425 2.75 . . . . 0.0 112.654 -178.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -70.89 153.93 42.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.839 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.6 mpp_? -156.5 119.99 4.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.844 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 62.1 m-70 -100.61 155.76 17.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.575 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 23.9 ttt -129.13 125.23 36.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.903 0.382 . . . . 0.0 111.249 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.502 ' CE2' ' CD1' ' A' ' 9' ' ' PHE . 91.9 m-85 -130.86 146.38 52.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.484 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 5.8 t -119.39 133.64 55.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.867 0.365 . . . . 0.0 110.983 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.444 ' CE2' ' HB1' ' A' ' 7' ' ' ALA . 2.5 m-85 -125.96 136.35 52.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.82 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.434 ' HA ' ' HE1' ' A' ' 58' ' ' MET . 34.2 m-20 -97.1 22.2 8.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.791 0.329 . . . . 0.0 111.076 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -144.99 107.28 4.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.573 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -52.83 -28.82 24.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.071 0.463 . . . . 0.0 111.055 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -77.16 -54.9 5.93 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.303 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 53.4 t -53.87 -46.97 64.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.856 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.66 -35.6 80.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.29 179.514 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -65.86 -32.79 74.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.559 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -66.71 -41.05 88.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.117 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.408 ' CD1' HG21 ' A' ' 16' ' ' ILE . 22.6 mm -66.29 -48.75 80.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.518 179.44 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.56 -27.63 67.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.57 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 40.6 mtm -78.48 -39.08 39.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.616 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.474 HG23 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -80.62 -32.03 36.44 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.658 179.841 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 13.6 mt -65.99 -39.33 90.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.621 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -62.71 -26.83 68.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.883 179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -70.33 -43.73 69.69 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.951 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.459 ' O ' ' HB2' ' A' ' 110' ' ' ARG . 4.1 mt -61.86 -47.02 95.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.327 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.441 ' H ' HG13 ' A' ' 108' ' ' ILE . 2.6 mt -57.43 -60.03 2.58 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.572 0 CA-C-O 121.838 0.828 . . . . 0.0 109.347 179.181 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.1 m -48.78 -28.92 3.99 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.088 -1.414 . . . . 0.0 111.266 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.459 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 35.3 mtt-85 -69.26 -32.54 71.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.044 0.45 . . . . 0.0 110.809 179.686 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -90.01 -28.8 18.85 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.926 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.84 -38.31 86.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.881 0.372 . . . . 0.0 110.543 179.568 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -62.13 -37.59 85.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.919 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.89 -33.43 75.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.079 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 89.7 m-20 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.173 -0.918 . . . . 0.0 110.857 179.989 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 74.8 mt . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.813 0.34 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -126.24 157.66 69.26 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.862 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -51.28 -40.43 61.26 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.594 2.196 . . . . 0.0 112.38 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 93.4 m-20 -58.67 -27.68 65.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.96 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -64.55 -42.88 95.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.875 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 38.4 mm -66.88 -23.88 31.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.319 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -63.87 -34.68 78.48 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.876 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.46 -30.43 68.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.025 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' TRP . . . . . 0.471 ' CE3' ' HE3' ' A' ' 59' ' ' MET . 11.9 m95 -55.88 -31.93 63.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.812 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' PHE . . . . . 0.41 ' CE2' HG23 ' A' ' 51' ' ' THR . 89.0 m-85 -89.0 -25.31 22.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.972 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.46 -33.25 60.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.817 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -74.97 136.73 41.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.929 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -147.66 161.55 35.02 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.937 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo . . . . . 0 C--O 1.248 0.976 0 C-N-CA 122.553 2.169 . . . . 0.0 112.272 -179.949 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo . . . . . 0 N--CA 1.475 0.396 0 CA-C-O 120.772 0.238 . . . . 0.0 111.785 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.2 t 61.04 114.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.049 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 61.4 m80 64.42 32.5 11.89 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.172 0.511 . . . . 0.0 110.989 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.55 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 77.4 p 177.6 161.73 0.52 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.594 179.237 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 162.78 116.19 0.37 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.296 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.597 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -46.64 103.6 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.192 0.52 . . . . 0.0 111.431 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.465 ' O ' ' O ' ' A' ' 14' ' ' GLY . . . -118.87 152.23 36.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.769 -178.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.544 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.0 OUTLIER -99.55 125.25 53.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.072 0.463 . . . . 0.0 110.419 179.009 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.507 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 10.0 t80 -113.34 130.12 56.36 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.132 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 82.5 mt-10 56.85 34.77 25.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.933 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.2 mttm 76.02 1.2 3.44 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.406 -179.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.528 ' O ' HG22 ' A' ' 8' ' ' ILE . 41.5 t -100.31 156.18 4.19 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.617 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.544 ' HA ' HG13 ' A' ' 8' ' ' ILE . 94.1 p -98.19 149.0 23.02 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 121.427 0.632 . . . . 0.0 112.588 -178.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.465 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 175.16 -179.74 46.24 Favored Glycine 0 N--CA 1.449 -0.493 0 CA-C-N 114.653 -1.158 . . . . 0.0 110.313 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.597 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.59 141.54 21.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 117.615 0.707 . . . . 0.0 110.406 179.344 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.55 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -106.63 118.45 54.37 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.737 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 179.565 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.466 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -120.99 131.19 54.15 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.17 0.51 . . . . 0.0 111.546 -178.467 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.424 ' CD1' HG22 ' A' ' 103' ' ' THR . 90.3 mt -106.08 138.57 30.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.056 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -131.32 117.18 18.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.149 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -93.63 4.93 53.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.189 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -79.12 -17.59 54.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.959 0.409 . . . . 0.0 110.318 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.22 141.22 17.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.873 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.42 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.0 t -114.28 116.33 44.33 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.825 179.893 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.42 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 1.2 Cg_endo -81.43 142.95 56.86 Favored 'Cis proline' 0 C--N 1.349 0.589 0 C-N-CA 123.807 -1.33 . . . . 0.0 111.934 0.102 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -45.33 141.64 2.47 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.142 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -136.59 167.15 21.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.158 0.504 . . . . 0.0 111.626 -179.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.1 tt -121.19 129.2 53.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.818 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.7 m -117.43 126.21 52.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.159 0.504 . . . . 0.0 112.177 -178.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.466 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 59.8 t90 -100.51 128.88 46.44 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.937 179.008 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 26.3 ttt180 -124.58 116.78 22.99 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.81 0.338 . . . . 0.0 111.069 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.434 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 16.3 m -46.11 168.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.125 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -42.07 61.72 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 121.48 0.657 . . . . 0.0 109.555 179.526 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -85.22 -20.19 30.52 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.832 -1.076 . . . . 0.0 111.03 179.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.01 33.26 11.09 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.513 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 51.9 t0 -100.55 -23.1 14.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.655 0.264 . . . . 0.0 111.425 -179.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.88 135.67 48.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.995 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 12.7 p -139.12 130.32 34.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.143 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.507 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 51.3 t60 -129.43 145.79 51.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.022 0.439 . . . . 0.0 111.291 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 46.1 m -129.07 135.05 48.39 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.965 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 98.7 t -126.26 140.87 47.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.161 0.505 . . . . 0.0 111.513 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.469 ' CG1' HG21 ' A' ' 44' ' ' THR . 2.1 p -85.51 117.55 30.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.409 ' HA ' HG12 ' A' ' 45' ' ' ILE . 72.5 mt -75.37 -29.66 59.96 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.995 -178.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.403 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 9.7 t -56.14 -21.71 24.22 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.225 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.469 HG21 ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -96.8 -21.89 17.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.699 0.285 . . . . 0.0 111.186 -179.794 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.409 HG12 ' HA ' ' A' ' 42' ' ' LEU . 38.0 mm -56.64 90.59 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.049 0.452 . . . . 0.0 110.89 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -71.06 -27.25 63.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.604 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.707 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 20.7 mttm -144.74 152.39 40.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.013 0.435 . . . . 0.0 111.629 -179.399 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.405 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -132.69 131.13 40.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.988 179.345 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -125.9 143.78 50.94 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.95 -179.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.26 145.94 31.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.979 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.42 HG23 ' CD2' ' B' ' 54' ' ' PHE . 42.5 p -75.7 128.26 84.06 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.505 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -61.41 154.16 60.91 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.573 2.182 . . . . 0.0 112.467 -179.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.87 -40.51 97.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.173 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 85.3 p -59.44 -26.8 65.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.859 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 29.5 m -86.32 117.37 25.08 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.843 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -56.38 -18.65 11.67 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.596 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.8 mmtm -71.83 124.0 23.88 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.029 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 27.3 mmm -104.15 118.9 37.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.498 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.422 ' HE2' ' CE3' ' B' ' 53' ' ' TRP . 2.4 ttm -175.75 161.62 2.58 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.176 0.512 . . . . 0.0 112.006 -179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.4 tt -153.59 123.94 7.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.756 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 29.8 ttp180 -117.94 138.03 52.44 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.432 ' N ' ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -112.44 136.17 52.26 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.259 179.291 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.707 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.3 mm -103.29 133.79 46.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.816 0.341 . . . . 0.0 111.142 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -101.93 134.07 11.61 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.076 179.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 40.1 mttt -44.1 137.5 3.35 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.942 0.401 . . . . 0.0 111.286 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.452 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.2 p -105.2 -162.13 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.009 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.452 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 52.1 t0 -173.55 68.99 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.261 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -56.0 -22.21 25.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.398 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.4 m -58.2 -18.87 29.04 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.907 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.7 mtmt -69.57 -42.62 74.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.981 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.7 mttt 60.26 92.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.866 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -92.03 137.9 31.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.873 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 28.8 mmtm -89.16 145.29 25.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.897 0.38 . . . . 0.0 110.893 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -93.29 171.95 8.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.883 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 40.7 t-20 -59.43 -20.53 55.74 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.301 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 50.7 mp0 -86.41 3.44 43.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.359 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.07 14.29 82.05 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.709 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -110.08 144.43 38.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.909 0.385 . . . . 0.0 110.969 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -70.73 147.26 49.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.094 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.424 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.8 m -140.48 158.65 24.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.028 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 20.3 t -83.64 110.19 23.23 Favored Pre-proline 0 C--N 1.326 -0.444 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.424 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 86.1 Cg_exo -46.2 145.26 5.7 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.196 1.931 . . . . 0.0 112.622 -178.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.505 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 8.5 mmtm -83.09 99.3 0.64 Allowed Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.126 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.505 ' HD2' ' HA ' ' A' ' 83' ' ' LYS . 1.3 Cg_endo -40.77 149.61 0.16 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 123.433 2.755 . . . . 0.0 112.598 179.165 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -65.38 139.64 58.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.776 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 12.0 mtp180 -150.5 120.02 6.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.868 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -103.48 143.49 32.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.579 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 23.7 ttt -118.55 131.91 56.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.231 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.501 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 94.1 m-85 -139.2 144.39 38.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.645 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 1.5 m -125.17 135.1 52.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.074 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.476 ' CD1' ' N ' ' A' ' 91' ' ' PHE . 2.1 m-85 -123.22 172.5 8.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.532 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 69.9 m-20 -126.74 26.9 6.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.005 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -157.3 121.77 4.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.607 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 32.9 mmt-85 -56.1 -36.18 67.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.026 0.441 . . . . 0.0 110.76 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.14 -55.17 15.32 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.919 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 55.3 t -61.13 -40.75 86.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.105 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.435 ' HG3' ' CD1' ' A' ' 91' ' ' PHE . 0.0 OUTLIER -69.31 -34.78 75.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.312 179.628 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.445 ' O ' ' HG2' ' A' ' 101' ' ' LYS . 67.3 m-20 -76.14 -31.02 58.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.08 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -62.23 -36.27 81.46 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.313 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.464 HG13 ' CE2' ' A' ' 91' ' ' PHE . 22.1 mm -70.57 -49.15 54.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.957 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.445 ' HG2' ' O ' ' A' ' 98' ' ' ASP . 4.4 pttt -64.8 -27.51 68.93 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.923 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.442 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.1 OUTLIER -78.55 -41.91 30.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.109 179.564 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.424 HG22 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -71.4 -41.4 69.66 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.641 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 13.9 mt -60.31 -41.1 92.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.801 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -61.87 -30.23 70.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.939 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -68.48 -36.27 78.7 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.118 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.464 ' CG2' ' CE2' ' A' ' 111' ' ' TYR . 6.6 mt -70.72 -46.65 68.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.476 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.423 ' CG2' ' CD ' ' A' ' 112' ' ' LYS . 2.5 mt -57.48 -61.09 1.42 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 CA-C-O 121.803 0.811 . . . . 0.0 109.385 179.157 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.4 p -50.28 -31.71 14.98 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.199 -1.364 . . . . 0.0 110.91 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 52.5 mtt-85 -68.63 -33.53 74.17 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.832 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.464 ' CE2' ' CG2' ' A' ' 107' ' ' ILE . 20.1 m-85 -92.19 -33.92 14.51 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.921 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.423 ' CD ' ' CG2' ' A' ' 108' ' ' ILE . 0.0 OUTLIER -65.02 -36.55 84.76 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.788 179.784 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -61.77 -37.02 82.75 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.936 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.06 -42.77 96.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.202 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 53.3 p30 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.945 -179.96 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 25.6 tp . . . . . 0 N--CA 1.485 1.312 0 CA-C-O 120.848 0.356 . . . . 0.0 111.295 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.7 m -124.61 164.21 32.06 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.831 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_exo -51.67 -43.24 52.15 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.577 2.185 . . . . 0.0 112.321 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -59.41 -28.0 66.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.964 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -62.24 -43.4 98.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.76 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 36.5 mm -67.69 -26.67 35.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.238 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -64.63 -33.79 76.75 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.933 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -32.91 74.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.671 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' TRP . . . . . 0.422 ' CE3' ' HE2' ' A' ' 59' ' ' MET . 11.4 m0 -57.26 -41.89 80.51 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.892 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' PHE . . . . . 0.42 ' CD2' HG23 ' A' ' 51' ' ' THR . 73.6 m-85 -68.0 -28.62 67.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.942 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -80.78 -38.32 28.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.855 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -59.72 139.99 56.83 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.898 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -141.03 163.44 42.33 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.914 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo . . . . . 0 C--O 1.25 1.101 0 C-N-CA 122.531 2.154 . . . . 0.0 112.287 179.949 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo . . . . . 0 N--CA 1.478 0.575 0 CA-C-O 120.791 0.246 . . . . 0.0 111.75 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.0 m -169.26 -60.96 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.951 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 64.2 m80 -126.43 33.27 5.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.15 0.5 . . . . 0.0 110.924 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.533 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 62.9 p 179.14 115.73 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.889 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.425 ' O ' ' C ' ' A' ' 6' ' ' ALA . . . -146.64 113.45 0.67 Allowed Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.929 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.522 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -32.93 120.09 0.34 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.769 0.319 . . . . 0.0 111.269 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.444 ' O ' ' O ' ' A' ' 14' ' ' GLY . . . -136.28 151.32 49.52 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -178.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.561 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.2 mp -98.54 125.36 51.92 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.27 0 CA-C-O 121.063 0.458 . . . . 0.0 110.523 179.29 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.504 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 7.4 t80 -117.05 130.13 56.47 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.015 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 58.58 33.81 23.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.814 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 69.8 mttt 75.46 1.6 3.66 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.149 -178.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.479 ' O ' HG23 ' A' ' 8' ' ' ILE . 31.3 t -101.44 148.4 7.34 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.745 0 CA-C-N 116.031 -0.532 . . . . 0.0 109.63 179.055 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.561 ' HA ' HG13 ' A' ' 8' ' ' ILE . 78.7 p -86.83 146.21 26.3 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-O 121.446 0.641 . . . . 0.0 111.523 -179.368 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.444 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . -175.6 -179.1 45.92 Favored Glycine 0 N--CA 1.441 -0.984 0 CA-C-N 115.056 -0.975 . . . . 0.0 111.764 -179.528 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.522 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 7.0 mm -106.21 136.01 42.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 120.849 0.357 . . . . 0.0 110.062 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.533 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.2 OUTLIER -106.6 117.85 53.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.836 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.453 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -123.61 132.13 53.79 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.337 0.589 . . . . 0.0 111.596 -178.049 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.449 ' CD1' HG23 ' A' ' 103' ' ' THR . 46.1 mt -102.46 133.0 47.36 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.058 -179.409 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -124.35 114.18 19.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.012 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -88.35 5.61 41.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.251 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -78.37 -18.23 55.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.911 0.386 . . . . 0.0 110.358 179.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -98.07 145.43 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.904 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 t -121.81 116.25 30.37 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.991 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.445 ' HG2' HG21 ' A' ' 41' ' ' VAL . 72.1 Cg_endo -76.22 149.79 92.35 Favored 'Cis proline' 0 C--N 1.35 0.612 0 C-N-CA 123.211 -1.579 . . . . 0.0 112.108 -0.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.14 137.56 5.96 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.801 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -128.35 164.18 23.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.148 0.499 . . . . 0.0 111.803 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.8 tt -121.12 129.19 53.18 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.696 179.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.0 m -116.5 129.0 55.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.137 0.494 . . . . 0.0 111.902 -179.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.483 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 57.8 t90 -100.37 125.68 46.66 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.139 179.083 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.19 116.51 23.52 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.638 179.731 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 11.2 m -44.42 158.36 0.05 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.704 0.288 . . . . 0.0 110.975 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.411 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -66.34 -39.45 89.22 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.494 0.664 . . . . 0.0 109.263 179.974 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 48.0 p30 -85.51 -20.8 29.13 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.213 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.77 32.71 12.4 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.649 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -99.5 -23.56 15.06 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.839 0.352 . . . . 0.0 111.467 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.3 mtmt -130.12 142.42 50.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.07 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 14.4 p -139.04 136.71 42.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.22 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.504 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 82.0 t60 -136.39 146.34 46.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.007 0.432 . . . . 0.0 111.347 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 43.5 m -127.47 136.95 52.5 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.951 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 92.6 t -132.38 140.87 46.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-O 121.018 0.437 . . . . 0.0 111.599 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.485 ' CG1' ' CG2' ' A' ' 44' ' ' THR . 0.8 OUTLIER -87.75 118.15 32.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 178.026 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.453 ' HA ' HG12 ' A' ' 45' ' ' ILE . 46.6 mt -71.61 -29.7 64.97 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -178.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.417 ' CB ' ' HB2' ' A' ' 24' ' ' PRO . 1.5 t -55.51 -22.22 20.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.671 0.272 . . . . 0.0 111.684 -179.39 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.485 ' CG2' ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -88.69 -24.96 22.6 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.786 0.327 . . . . 0.0 111.252 -179.653 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.453 HG12 ' HA ' ' A' ' 42' ' ' LEU . 50.5 mm -56.04 91.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.064 0.459 . . . . 0.0 111.021 -179.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 63' ' ' ILE . 7.1 t0 -78.59 -25.82 45.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.598 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 7.2 mmmt -148.32 148.59 30.58 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.053 0.454 . . . . 0.0 111.518 -179.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 41.2 mt -115.68 124.37 50.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.498 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -115.15 137.84 51.57 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.76 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.89 151.27 37.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.014 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 55.1 p -75.72 130.31 79.3 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.58 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.32 158.46 44.64 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.583 2.189 . . . . 0.0 112.489 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.59 -43.0 97.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.066 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.1 m -59.35 -27.59 66.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.072 0.463 . . . . 0.0 110.822 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 31.5 t -82.31 119.55 24.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.896 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -57.18 -18.27 14.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.44 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.419 ' HD2' ' CE3' ' B' ' 53' ' ' TRP . 35.8 mmtm -60.45 155.85 17.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.854 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.423 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 17.3 mtp -143.02 79.9 1.66 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.794 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.429 ' CE ' ' CE3' ' B' ' 53' ' ' TRP . 0.2 OUTLIER -147.55 167.22 25.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.061 0.458 . . . . 0.0 111.63 -179.669 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.2 tp -136.46 128.66 29.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.034 179.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -114.26 122.03 45.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.945 0.402 . . . . 0.0 111.788 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.451 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.3 OUTLIER -97.24 139.6 32.97 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.924 179.014 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.456 ' O ' ' N ' ' A' ' 46' ' ' ASP . 0.9 OUTLIER -115.66 119.22 61.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.017 -179.686 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -89.49 151.77 22.13 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.248 179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.8 mttm -59.06 135.51 57.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.805 0.336 . . . . 0.0 110.762 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.456 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.3 p -79.62 -167.55 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.169 0.509 . . . . 0.0 111.193 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.456 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 54.2 p-10 -148.44 59.51 1.08 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.638 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -56.01 -22.55 27.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.387 -179.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.4 t -59.62 -17.52 34.07 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.015 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.8 mmtp -71.01 -50.68 31.51 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.761 0.315 . . . . 0.0 111.092 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.4 mmtm 63.43 95.22 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.712 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 31.6 mmt180 -99.65 168.64 9.8 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.804 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.9 mttt -124.91 146.69 49.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.96 0.409 . . . . 0.0 111.08 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -86.28 171.93 10.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.8 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -62.15 -18.11 59.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.343 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -85.95 4.38 37.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.569 0.223 . . . . 0.0 111.425 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 83.54 3.22 89.87 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.78 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -91.26 168.14 11.81 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.738 0.304 . . . . 0.0 110.763 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -94.89 153.38 17.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.851 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.413 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.2 m -138.18 158.9 32.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.969 0.414 . . . . 0.0 111.222 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 38.5 t -101.93 98.74 10.52 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.563 178.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.413 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 93.5 Cg_exo -42.81 145.34 1.12 Allowed 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.537 2.158 . . . . 0.0 112.779 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.448 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 11.4 mttp -84.35 148.58 53.01 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.054 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 16.4 Cg_exo -73.06 162.4 40.96 Favored 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 123.509 2.806 . . . . 0.0 112.741 -178.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -65.45 144.03 57.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.802 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 32.9 mtp180 -145.12 119.92 9.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.935 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 58.2 m-70 -107.4 159.11 16.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.61 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.1 ttt -130.44 132.03 45.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.029 0.442 . . . . 0.0 111.345 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.491 ' CE2' ' CD1' ' A' ' 9' ' ' PHE . 87.6 m-85 -138.62 145.99 41.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.459 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -118.96 133.87 55.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.809 0.338 . . . . 0.0 111.1 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.502 ' CD1' ' N ' ' A' ' 91' ' ' PHE . 1.4 m-85 -127.5 158.24 37.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.573 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.423 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 53.5 m-20 -115.79 25.53 10.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.936 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 -156.68 108.03 2.42 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.487 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 8.9 tpp180 -46.86 -29.87 2.21 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.005 0.431 . . . . 0.0 111.288 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.2 -54.0 9.54 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.537 -179.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 58.1 t -53.63 -49.66 54.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.827 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.415 ' HB3' ' CG ' ' A' ' 91' ' ' PHE . 18.7 ptm -63.98 -37.22 86.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.0 0.429 . . . . 0.0 110.064 179.386 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -66.38 -31.2 71.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.511 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -67.89 -40.46 83.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.931 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.412 ' CD1' HG23 ' A' ' 16' ' ' ILE . 24.7 mm -66.43 -49.77 72.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.423 179.273 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 3.9 pttt -66.01 -27.28 68.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.46 179.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 64.6 mtp -78.25 -40.19 37.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.542 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.449 HG23 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -79.11 -37.18 39.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.514 179.735 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 12.0 mt -61.59 -39.56 91.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.767 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.65 -29.1 69.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.878 179.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 99.6 mm-40 -69.23 -33.8 73.83 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.811 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.441 ' CG2' ' CE2' ' A' ' 111' ' ' TYR . 4.0 mt -72.52 -44.48 61.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.308 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.439 ' CG2' ' CD ' ' A' ' 112' ' ' LYS . 2.6 mt -58.84 -61.18 1.52 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.551 0 CA-C-O 121.764 0.792 . . . . 0.0 109.474 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.1 t -50.91 -28.84 10.51 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.16 -1.382 . . . . 0.0 110.943 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 49.3 mtt180 -70.32 -33.7 71.82 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.762 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.441 ' CE2' ' CG2' ' A' ' 107' ' ' ILE . 19.9 m-85 -92.32 -35.33 13.8 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.938 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.439 ' CD ' ' CG2' ' A' ' 108' ' ' ILE . 0.2 OUTLIER -63.68 -40.53 97.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.741 179.802 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -60.34 -37.13 79.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.878 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.73 -32.93 74.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.068 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 43.1 t0 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.163 -0.922 . . . . 0.0 111.277 179.824 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 7.0 tt . . . . . 0 N--CA 1.485 1.304 0 CA-C-O 120.83 0.347 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 5.7 t -124.47 152.2 68.06 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.751 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -48.6 -39.86 37.58 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.606 2.204 . . . . 0.0 112.324 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -62.06 -27.14 68.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.696 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -64.75 -45.62 85.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.861 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 31.2 mm -66.33 -26.67 38.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.215 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -65.47 -33.73 76.63 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.915 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.36 -28.56 67.23 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.204 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' TRP . . . . . 0.429 ' CE3' ' CE ' ' A' ' 59' ' ' MET . 11.5 m0 -54.26 -29.2 46.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.842 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -97.51 -24.94 15.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.976 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -81.07 -29.65 34.91 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.793 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 45.0 -166.39 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.367 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -123.46 78.41 54.39 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.901 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo . . . . . 0 C--O 1.249 1.037 0 C-N-CA 122.507 2.138 . . . . 0.0 112.313 -179.999 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo . . . . . 0 N--CA 1.477 0.512 0 CA-C-O 120.801 0.25 . . . . 0.0 111.862 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.2 t 61.22 -83.08 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.163 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.436 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 55.1 m80 -117.37 37.9 3.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.982 0.42 . . . . 0.0 111.265 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 1.2 m -166.68 176.62 7.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.671 179.258 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 159.08 126.09 0.84 Allowed Glycine 0 N--CA 1.444 -0.814 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.321 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.567 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -53.65 111.65 0.77 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.018 0.437 . . . . 0.0 111.192 -179.689 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.442 ' O ' ' O ' ' A' ' 14' ' ' GLY . . . -125.81 150.27 47.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.831 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.525 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -100.14 125.78 53.8 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.267 0 CA-C-O 120.979 0.418 . . . . 0.0 110.222 179.049 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.507 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 6.1 t80 -112.93 131.16 55.85 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.284 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.0 mt-10 55.07 34.25 22.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.859 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.0 mttp 76.44 0.8 3.26 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.365 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.521 ' O ' HG21 ' A' ' 8' ' ' ILE . 40.4 t -98.78 154.25 4.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 178.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.525 ' HA ' HG13 ' A' ' 8' ' ' ILE . 83.6 p -96.32 149.0 22.17 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 121.721 0.772 . . . . 0.0 112.742 -178.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.442 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 175.7 -179.69 46.72 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 114.449 -1.25 . . . . 0.0 110.292 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.567 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.71 144.35 15.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 117.673 0.736 . . . . 0.0 110.529 179.36 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.461 HG22 HD11 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -106.81 118.55 54.77 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 CA-C-N 115.358 -0.837 . . . . 0.0 108.835 179.577 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.5 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -121.14 132.31 54.78 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.355 -178.689 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.44 ' CD1' HG23 ' A' ' 103' ' ' THR . 59.3 mt -104.08 140.1 23.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.074 -179.163 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -132.51 111.46 11.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.862 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -90.36 5.2 48.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.325 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -78.9 -17.76 55.02 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.954 0.406 . . . . 0.0 110.36 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.62 142.97 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.947 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.5 t -115.81 116.77 40.47 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.834 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -80.08 144.65 69.92 Favored 'Cis proline' 0 C--N 1.348 0.534 0 C-N-CA 123.707 -1.372 . . . . 0.0 111.933 0.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.78 139.58 5.25 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.886 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -133.49 167.27 20.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.088 0.47 . . . . 0.0 111.661 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.6 tt -120.97 128.78 53.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.639 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.3 m -114.74 127.48 55.77 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.208 0.528 . . . . 0.0 112.085 -178.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.478 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 56.3 t90 -100.43 128.8 46.39 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.8 179.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 14.6 tpt180 -123.51 116.04 22.52 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.79 0.329 . . . . 0.0 110.976 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.425 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 30.9 t -45.37 164.36 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.062 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.41 -41.56 66.12 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.482 0.658 . . . . 0.0 109.507 179.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -82.32 -22.17 35.72 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.792 -1.094 . . . . 0.0 111.027 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.72 32.99 10.42 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.458 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -106.82 -20.18 13.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.712 0.291 . . . . 0.0 111.433 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.46 135.0 48.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.799 0.333 . . . . 0.0 111.109 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 13.2 p -139.15 138.93 40.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.042 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.507 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 77.5 t60 -136.81 146.24 45.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.082 0.468 . . . . 0.0 111.364 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 48.2 m -127.15 132.77 50.46 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.073 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 95.7 t -124.32 140.87 46.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.457 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.468 ' CG1' HG22 ' A' ' 44' ' ' THR . 2.1 p -85.2 117.33 30.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 178.1 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.457 ' HA ' HG12 ' A' ' 45' ' ' ILE . 68.5 mt -75.7 -30.42 59.33 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.124 -178.538 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 60.5 p -56.12 -21.74 24.2 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -179.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.468 HG22 ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -93.91 -24.73 17.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.742 0.306 . . . . 0.0 111.287 -179.704 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.457 HG12 ' HA ' ' A' ' 42' ' ' LEU . 42.7 mm -51.17 93.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.983 0.421 . . . . 0.0 110.918 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -77.54 -27.68 51.7 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.511 -179.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.525 ' HG2' HD12 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -140.3 159.15 42.83 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 121.201 0.524 . . . . 0.0 111.381 -179.298 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 27.4 mt -126.89 124.24 39.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.953 178.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.4 ' O ' ' N ' ' A' ' 61' ' ' ARG . 79.9 mt-30 -120.81 136.9 54.78 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.977 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -148.23 151.23 35.12 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.115 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 60.5 p -75.56 126.82 87.01 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.44 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -59.51 155.85 39.61 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.55 2.167 . . . . 0.0 112.515 -179.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.48 -43.08 97.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.091 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 93.6 p -59.59 -27.62 66.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.038 0.447 . . . . 0.0 110.722 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 26.3 t -80.62 120.9 25.16 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.954 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -56.65 -18.48 12.35 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.334 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.419 ' HD2' ' CE3' ' B' ' 53' ' ' TRP . 30.4 mmtt -66.79 156.49 35.38 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.872 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.446 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 31.7 mtp -143.0 89.89 2.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.743 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.453 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 44.3 mtm -155.74 156.36 34.72 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.052 0.453 . . . . 0.0 111.817 -179.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.425 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -131.61 123.9 28.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.38 179.707 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.401 ' NH2' ' NE ' ' A' ' 86' ' ' ARG . 39.0 mtp180 -107.82 127.08 53.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.847 0.355 . . . . 0.0 111.333 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.481 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -111.04 123.45 50.22 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.943 -179.929 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.536 ' CG1' ' HG2' ' A' ' 86' ' ' ARG . 3.9 mp -109.64 136.04 46.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.831 0.348 . . . . 0.0 111.136 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.9 -169.42 38.21 Favored Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.378 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.91 143.43 34.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.759 0.314 . . . . 0.0 110.807 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.456 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.3 p -99.97 -162.25 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.045 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.456 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 14.3 t70 -175.14 70.97 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.254 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 -56.9 -20.61 24.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.492 -179.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 27.1 t -57.51 -18.59 19.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.206 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.3 mmmt -57.76 -46.77 84.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.068 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? 62.29 94.32 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.856 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 57.7 mmm-85 -107.64 154.92 20.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.822 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -119.11 145.33 46.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.908 0.385 . . . . 0.0 111.041 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -84.85 171.27 12.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.865 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -61.97 -18.09 59.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.384 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -85.41 4.67 34.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.551 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 81.61 6.57 89.02 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.722 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -94.23 162.07 14.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.707 0.289 . . . . 0.0 110.681 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -94.97 151.83 18.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.938 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.436 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.3 m -135.41 158.93 40.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.15 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 19.4 t -101.05 98.73 9.13 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.708 178.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.436 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 92.1 Cg_exo -42.81 145.52 1.07 Allowed 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.562 2.175 . . . . 0.0 112.845 -179.005 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -104.48 150.84 38.93 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.715 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -72.43 147.14 46.09 Favored 'Trans proline' 0 N--CA 1.464 -0.207 0 C-N-CA 123.524 2.816 . . . . 0.0 112.699 -178.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -65.63 133.73 51.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.905 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.536 ' HG2' ' CG1' ' A' ' 63' ' ' ILE . 10.4 mtm180 -123.94 124.43 42.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.767 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -93.49 159.15 15.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.554 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 25.4 ttt -133.45 128.99 36.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.87 0.367 . . . . 0.0 111.381 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.445 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 97.9 m-85 -139.68 148.99 43.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.603 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.453 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 2.8 t -125.64 124.17 40.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.841 0.353 . . . . 0.0 110.937 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.425 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 3.8 m-85 -112.44 170.61 8.05 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.914 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.446 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 27.7 p30 -128.76 26.09 5.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.146 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -153.53 112.05 3.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.65 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.71 -33.0 63.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.208 0.528 . . . . 0.0 110.902 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.19 -49.64 54.81 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.162 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 47.9 t -58.89 -40.64 80.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.556 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -63.48 -33.56 75.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.431 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -65.44 -35.4 80.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.741 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -69.28 -41.19 77.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.806 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.418 HD12 ' CG2' ' A' ' 16' ' ' ILE . 21.5 mm -62.76 -52.02 64.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.738 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 5.6 mtpp -64.55 -27.87 69.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.723 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 36.3 mtm -78.42 -36.88 45.06 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.062 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.44 HG23 ' CD1' ' A' ' 18' ' ' ILE . 0.5 OUTLIER -82.06 -38.96 24.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.009 -179.792 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 16.2 mt -64.08 -39.67 94.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.841 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -64.46 -29.34 70.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.865 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -69.37 -31.64 70.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.921 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.412 ' CD1' ' CD1' ' A' ' 42' ' ' LEU . 5.9 mt -74.89 -46.43 40.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.282 -179.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.437 ' H ' HG13 ' A' ' 108' ' ' ILE . 2.2 mt -58.22 -61.24 1.44 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.589 0 CA-C-O 121.689 0.757 . . . . 0.0 109.343 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.5 m -50.53 -28.91 9.39 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.325 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.92 -41.56 97.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.449 179.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 75.5 m-85 -83.64 -29.65 27.51 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.344 179.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 18.9 mttt -63.03 -43.3 99.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.502 179.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -59.34 -38.05 79.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.859 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.41 -32.59 74.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.134 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 51.9 t0 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.328 -0.844 . . . . 0.0 110.893 179.99 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . 0.417 ' CD1' ' N ' ' B' ' 45' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.838 0.351 . . . . 0.0 111.341 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.1 m -130.1 167.49 20.49 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.912 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -50.74 -46.22 31.28 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.572 2.182 . . . . 0.0 112.487 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -63.49 -31.74 72.98 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.895 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -64.88 -40.97 95.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.893 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 35.2 mm -68.12 -24.24 29.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.363 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -63.17 -35.55 80.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.827 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' GLN . . . . . 0.415 ' HG2' ' CD1' ' B' ' 53' ' ' TRP . 4.9 pt20 -58.19 -41.27 83.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.13 0.49 . . . . 0.0 110.872 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' TRP . . . . . 0.419 ' CE3' ' HD2' ' A' ' 57' ' ' LYS . 47.9 m95 -56.62 -29.92 62.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.112 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -108.15 -0.7 20.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.205 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -99.05 -29.7 12.74 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 120.706 0.289 . . . . 0.0 110.945 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -58.98 139.62 56.57 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.994 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -142.08 164.92 30.8 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.855 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo . . . . . 0 C--O 1.248 1.019 0 C-N-CA 122.54 2.16 . . . . 0.0 112.282 -179.98 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo . . . . . 0 N--CA 1.476 0.469 0 CA-C-O 120.857 0.274 . . . . 0.0 111.817 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.0 t 60.75 112.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.932 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 52.8 m80 62.19 32.6 17.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.218 0.533 . . . . 0.0 110.876 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.585 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 75.1 p 178.11 162.41 0.63 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.572 179.177 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.401 ' CA ' ' CG1' ' A' ' 96' ' ' VAL . . . 161.6 116.27 0.39 Allowed Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.716 -0.755 . . . . 0.0 112.535 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.586 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -46.88 102.87 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.104 0.478 . . . . 0.0 111.298 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.48 ' CB ' ' CE2' ' A' ' 91' ' ' PHE . . . -117.64 151.79 36.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.931 -178.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.532 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.9 OUTLIER -98.78 123.88 51.65 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.26 0 CA-C-O 121.101 0.477 . . . . 0.0 110.373 178.918 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.504 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 14.3 t80 -112.26 130.17 56.02 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.045 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 56.52 34.35 24.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.731 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.8 mtpm? 75.88 1.7 3.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.287 -179.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.513 ' O ' HG21 ' A' ' 8' ' ' ILE . 40.8 t -100.8 154.57 4.56 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.596 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.001 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.532 ' HA ' HG13 ' A' ' 8' ' ' ILE . 89.5 p -95.66 149.42 21.48 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 121.549 0.69 . . . . 0.0 112.646 -178.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.445 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 174.54 -179.73 45.68 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 114.645 -1.161 . . . . 0.0 110.41 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.586 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.83 141.91 20.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 117.795 0.797 . . . . 0.0 110.579 179.426 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.585 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -106.77 118.48 54.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 179.62 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.475 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -121.83 130.44 53.39 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.525 -178.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.435 ' CD1' HG21 ' A' ' 103' ' ' THR . 77.2 mt -101.45 129.7 52.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.12 -179.526 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 51.6 t30 -116.1 111.44 20.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.034 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -89.75 7.03 38.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.165 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -78.94 -18.47 53.74 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.852 0.358 . . . . 0.0 110.384 179.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.502 ' CG2' ' N ' ' A' ' 23' ' ' SER . 0.5 OUTLIER -100.19 159.77 3.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.892 -179.961 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.502 ' N ' ' CG2' ' A' ' 22' ' ' VAL . 2.0 t -131.04 117.11 16.98 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.04 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -77.12 147.48 85.89 Favored 'Cis proline' 0 C--N 1.349 0.581 0 C-N-CA 123.36 -1.517 . . . . 0.0 112.188 0.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.22 136.51 9.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.727 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -128.07 166.89 17.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.222 0.534 . . . . 0.0 111.673 -179.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.0 tt -121.27 132.97 55.12 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.852 179.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 49.8 m -119.68 126.95 52.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.155 0.502 . . . . 0.0 112.031 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.466 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 57.9 t90 -100.58 130.31 46.62 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.884 179.116 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 24.4 tpt85 -125.25 114.99 19.67 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.837 0.351 . . . . 0.0 110.725 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.426 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 72.5 p -45.47 165.37 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.06 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.59 -42.35 58.87 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.481 0.658 . . . . 0.0 109.795 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -78.55 -22.74 46.78 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.101 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.52 33.44 10.27 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.381 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -111.36 -18.67 12.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.56 0.219 . . . . 0.0 111.588 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.3 mtmt -128.65 134.57 48.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.909 0.385 . . . . 0.0 111.187 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 11.0 p -139.26 141.83 34.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.038 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.504 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 71.0 t60 -137.6 146.1 43.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.125 0.488 . . . . 0.0 111.286 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 37.2 m -127.74 135.11 49.7 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.97 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.6 t -130.72 140.86 47.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 121.008 0.432 . . . . 0.0 111.548 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.521 ' CG1' ' CG2' ' A' ' 44' ' ' THR . 1.3 p -86.37 118.11 32.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.178 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.477 ' HA ' HG12 ' A' ' 45' ' ' ILE . 63.9 mt -70.89 -31.2 67.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.239 -0.437 . . . . 0.0 112.159 -178.34 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 2.0 t -52.67 -23.79 7.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.759 0.314 . . . . 0.0 111.543 -179.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.521 ' CG2' ' CG1' ' A' ' 41' ' ' VAL . 0.2 OUTLIER -86.25 -25.94 25.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.092 -179.866 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.477 HG12 ' HA ' ' A' ' 42' ' ' LEU . 41.6 mm -49.62 98.8 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.045 0.45 . . . . 0.0 111.116 -179.627 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -94.22 -21.01 19.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.583 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 61.2 mttm -156.61 137.68 13.61 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.976 0.417 . . . . 0.0 111.362 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 60.0 mt -109.37 124.26 50.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.595 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.424 ' HG3' ' CD1' ' B' ' 54' ' ' PHE . 4.8 tp60 -109.66 130.93 55.47 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.55 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -141.87 140.79 32.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.192 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 71.3 p -75.7 124.0 88.59 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.523 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -61.51 160.31 28.43 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.578 2.185 . . . . 0.0 112.598 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.58 -42.97 97.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.095 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 86.2 p -60.26 -27.66 67.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.041 0.448 . . . . 0.0 110.603 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 28.7 t -81.22 119.9 24.2 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.806 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.1 tp10 -55.88 -18.86 9.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.386 179.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.1 mmtt -60.42 151.62 27.65 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.895 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.449 ' HE3' ' HA ' ' A' ' 92' ' ' ASN . 45.6 mtp -143.14 89.46 2.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.606 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 3.0 tmm? -172.85 147.22 1.67 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.001 0.429 . . . . 0.0 111.469 -179.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.39 134.53 54.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.309 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.429 ' HB2' ' CZ ' ' B' ' 54' ' ' PHE . 0.5 OUTLIER -120.82 124.22 44.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.036 0.446 . . . . 0.0 111.742 -179.519 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.436 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.4 OUTLIER -94.89 144.14 25.9 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.433 179.386 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 1.2 mm -118.27 124.01 72.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.019 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -92.17 154.53 22.42 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.534 -0.841 . . . . 0.0 112.367 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 37.3 mttt -67.75 155.56 39.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.837 0.351 . . . . 0.0 110.851 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.443 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.3 p -121.16 -162.31 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.996 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.443 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 40.6 t0 -177.67 71.11 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.234 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 82.0 mt-10 -55.13 -23.38 20.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.341 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.9 m -62.93 -15.04 53.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.935 179.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.3 mmtt -66.81 -43.86 82.75 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.709 0.29 . . . . 0.0 111.038 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.4 mptt 60.67 93.09 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.781 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.47 137.91 41.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.87 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.9 mmtp -83.7 145.33 28.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.088 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -88.02 176.82 7.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.975 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -67.01 -15.99 64.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.404 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -88.38 -7.9 55.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.242 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 94.37 9.27 59.25 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.626 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -103.29 145.7 29.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.791 0.329 . . . . 0.0 110.864 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -78.4 140.87 38.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.963 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.436 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 1.3 m -140.56 152.63 21.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.191 0.52 . . . . 0.0 111.387 -179.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.3 p -85.29 109.03 18.17 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.554 178.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.436 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 52.2 Cg_exo -53.22 145.55 43.4 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.128 1.885 . . . . 0.0 112.483 -178.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.421 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 2.9 mmpt? -89.97 154.52 47.52 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.997 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 19.2 Cg_exo -71.48 144.26 44.76 Favored 'Trans proline' 0 N--CA 1.465 -0.189 0 C-N-CA 123.514 2.81 . . . . 0.0 112.685 -178.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -66.43 141.93 57.76 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.97 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.9 mtm180 -144.78 120.0 10.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.651 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.405 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 68.3 m-70 -109.55 159.05 17.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.538 179.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 13.7 ttt -133.62 139.96 46.82 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.076 0.465 . . . . 0.0 111.401 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.496 ' CE2' ' CD1' ' A' ' 9' ' ' PHE . 91.7 m-85 -148.71 125.35 11.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.146 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 27.0 t -101.63 134.52 44.64 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.967 0.413 . . . . 0.0 111.542 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.48 ' CE2' ' CB ' ' A' ' 7' ' ' ALA . 2.2 m-85 -123.37 130.3 52.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.583 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.449 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 12.9 m120 -74.3 -18.57 60.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.353 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 -114.51 114.36 25.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.827 0.346 . . . . 0.0 110.825 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.94 -26.64 26.46 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.057 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.14 -46.04 62.34 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.255 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.401 ' CG1' ' CA ' ' A' ' 5' ' ' GLY . 61.4 t -58.49 -52.36 60.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.622 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.451 ' HB3' ' CG ' ' A' ' 91' ' ' PHE . 9.8 ptm -60.24 -32.35 71.06 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 47.3 t0 -61.55 -35.02 76.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.388 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.401 ' O ' ' HB ' ' A' ' 103' ' ' THR . 65.6 m-80 -71.66 -44.42 64.34 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.459 179.504 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.437 ' CD1' HG21 ' A' ' 16' ' ' ILE . 23.2 mm -60.53 -52.1 65.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.14 0.495 . . . . 0.0 110.679 179.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -62.2 -30.88 71.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.799 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 41.8 mtm -78.56 -40.45 34.76 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.855 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.435 HG21 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -76.06 -42.99 45.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.874 -179.879 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 18.0 mt -60.73 -37.07 80.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.772 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -63.43 -29.75 70.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.836 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -67.4 -37.1 82.57 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.972 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.452 ' CG2' ' CE2' ' A' ' 111' ' ' TYR . 3.5 mt -68.51 -44.08 83.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.294 -179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.427 ' H ' HG13 ' A' ' 108' ' ' ILE . 2.5 mt -60.83 -61.21 1.66 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.589 0 CA-C-O 121.847 0.832 . . . . 0.0 109.393 179.08 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 27.5 m -53.27 -28.85 29.9 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.172 -1.376 . . . . 0.0 110.853 179.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 51.4 mtt-85 -72.45 -33.74 67.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.666 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.452 ' CE2' ' CG2' ' A' ' 107' ' ' ILE . 22.3 m-30 -87.99 -31.12 19.52 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.842 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.95 -35.37 79.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.045 0.45 . . . . 0.0 110.64 179.637 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -58.28 -37.09 74.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.939 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.25 -33.54 74.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.138 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.312 -0.852 . . . . 0.0 110.871 179.968 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 26.5 tp . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.849 0.357 . . . . 0.0 111.171 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.6 m -126.99 166.29 23.47 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.923 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_exo -51.31 -44.78 41.13 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.583 2.189 . . . . 0.0 112.325 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -58.9 -29.98 67.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.798 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -62.65 -41.2 98.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.719 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 34.3 mm -67.09 -27.77 40.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.305 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.04 -32.04 73.55 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.787 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -28.55 68.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.815 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' TRP . . . . . . . . . . . . . 12.8 m0 -55.98 -40.91 73.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.014 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' PHE . . . . . 0.429 ' CZ ' ' HB2' ' A' ' 61' ' ' ARG . 98.0 m-85 -84.92 -24.24 28.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.017 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -76.5 -43.35 39.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.929 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -62.92 136.06 57.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.034 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -136.39 76.11 50.43 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.809 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo . . . . . 0 C--O 1.249 1.067 0 C-N-CA 122.595 2.197 . . . . 0.0 112.32 179.887 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo . . . . . 0 N--CA 1.477 0.513 0 CA-C-O 120.853 0.272 . . . . 0.0 111.821 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.4 t 57.32 103.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.887 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 78.0 m80 63.59 32.68 13.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.244 0.545 . . . . 0.0 111.039 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.649 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 80.6 p 178.47 172.99 0.7 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.688 178.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.412 ' CA ' ' CG1' ' A' ' 96' ' ' VAL . . . 153.17 117.2 0.67 Allowed Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.028 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.557 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -39.82 117.85 0.8 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.897 0.379 . . . . 0.0 111.224 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.46 ' N ' ' O ' ' A' ' 14' ' ' GLY . . . -134.47 152.03 51.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.738 -179.114 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.564 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.2 mp -98.39 126.69 51.41 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.263 0 CA-C-O 121.138 0.494 . . . . 0.0 110.78 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.507 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 9.5 t80 -118.82 128.66 54.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.724 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 82.4 mt-10 59.02 36.79 24.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.595 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.421 ' HB2' ' O ' ' A' ' 10' ' ' GLU . 1.6 mtmt 72.13 2.43 4.31 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.31 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.466 ' O ' ' N ' ' A' ' 9' ' ' PHE . 30.0 t -102.37 146.68 10.03 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.71 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.564 ' HA ' HG13 ' A' ' 8' ' ' ILE . 88.0 p -85.96 146.71 26.56 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.595 -179.294 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.46 ' O ' ' N ' ' A' ' 7' ' ' ALA . . . -177.33 -179.1 47.47 Favored Glycine 0 N--CA 1.442 -0.907 0 CA-C-N 115.168 -0.924 . . . . 0.0 111.758 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.557 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.0 mm -104.48 137.57 32.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-O 120.951 0.405 . . . . 0.0 110.229 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.649 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -106.73 118.22 54.05 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 178.758 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.537 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -125.63 124.44 41.19 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.162 0.506 . . . . 0.0 111.484 -178.01 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.431 ' CD1' HG21 ' A' ' 103' ' ' THR . 76.5 mt -98.72 139.24 21.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.04 -179.444 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -130.93 112.31 12.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.954 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -86.62 0.63 54.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.341 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -76.57 -17.79 59.02 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 121.029 0.442 . . . . 0.0 110.283 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -95.99 134.86 32.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.858 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -111.37 116.68 50.59 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.016 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -78.21 154.05 92.9 Favored 'Cis proline' 0 C--N 1.349 0.554 0 C-N-CA 123.387 -1.505 . . . . 0.0 112.125 0.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -49.3 138.34 12.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.891 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -134.26 162.54 31.9 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.174 0.512 . . . . 0.0 111.517 -179.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.8 tt -121.25 125.39 46.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.536 179.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.2 m -113.24 126.95 55.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.156 0.503 . . . . 0.0 112.295 -178.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.46 ' CD2' ' CB ' ' A' ' 9' ' ' PHE . 64.2 t90 -100.41 128.97 46.33 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.914 178.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.9 ttm105 -128.31 117.94 22.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.824 179.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.418 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 17.0 t -44.73 155.88 0.09 Allowed 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.768 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.431 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -65.06 -39.62 93.53 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.529 0.681 . . . . 0.0 109.349 -179.925 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -79.99 -25.32 40.35 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 114.634 -1.166 . . . . 0.0 111.132 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 90.97 31.65 9.71 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.662 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -101.9 -21.2 14.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.61 0.243 . . . . 0.0 111.442 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 11.8 mtmt -128.69 138.33 52.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.764 0.316 . . . . 0.0 111.141 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 47.4 t -139.09 132.85 39.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.032 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.507 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 65.5 t60 -136.65 146.31 45.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.137 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 49.0 m -127.68 139.1 52.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.107 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 96.1 t -128.49 140.91 47.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.183 0.516 . . . . 0.0 111.674 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.467 ' CG1' ' CG2' ' A' ' 44' ' ' THR . 2.0 p -87.64 118.17 32.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.386 -0.825 . . . . 0.0 109.22 178.215 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 89.2 mt -73.5 -30.72 63.31 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -178.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.14 -24.3 10.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.819 0.342 . . . . 0.0 111.69 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.467 ' CG2' ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -92.58 -24.67 18.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.103 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 39.2 mm -61.25 85.44 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.712 -179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -70.81 -29.04 65.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.543 -179.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.624 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 10.0 mmmt -139.35 146.44 40.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.024 0.44 . . . . 0.0 111.789 -179.234 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -126.74 126.36 43.34 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.741 179.138 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -119.87 149.45 42.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.971 0.415 . . . . 0.0 111.236 -179.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.407 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . . . -148.08 146.76 28.97 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.953 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 54.6 p -75.87 122.73 87.57 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.332 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -61.42 160.32 27.99 Favored 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 122.597 2.198 . . . . 0.0 112.578 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.68 -42.75 93.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.103 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 86.3 p -57.92 -26.94 62.87 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.044 0.45 . . . . 0.0 110.783 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.7 t -85.69 118.57 25.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.845 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -56.69 -18.5 12.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.542 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.426 ' HD2' ' CE3' ' B' ' 53' ' ' TRP . 69.3 mmtt -63.54 147.1 52.31 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.954 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 19.6 mmm -133.74 85.0 2.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.592 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.448 ' CE ' ' CE3' ' B' ' 53' ' ' TRP . 31.7 mtm -154.67 165.87 35.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.229 0.538 . . . . 0.0 112.002 -179.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.407 ' CD1' ' HB3' ' A' ' 50' ' ' ALA . 2.8 tp -133.79 126.81 31.4 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.997 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.1 ttt180 -117.1 127.18 53.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.928 0.394 . . . . 0.0 111.882 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.446 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -106.42 144.1 33.59 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.269 179.482 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.624 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 2.0 mm -111.27 126.04 68.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.818 0.342 . . . . 0.0 111.211 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -91.25 131.91 11.01 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.2 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -44.3 137.84 3.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.847 0.356 . . . . 0.0 111.245 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.477 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.4 p -93.85 -162.39 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.052 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.477 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 52.1 t0 -167.38 73.28 0.12 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.088 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 85.6 mt-10 -55.11 -21.97 14.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.439 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 37.1 m -57.06 -19.01 16.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.174 179.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.78 -54.57 43.56 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.986 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.5 mmtt 60.92 93.64 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.838 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 10.8 mtt180 -111.22 143.83 41.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.835 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.1 mttp -98.48 145.21 27.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.168 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -87.65 175.25 7.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.899 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -64.31 -19.52 65.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.39 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 51.8 mp0 -86.95 6.39 32.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.59 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.47 14.59 82.33 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.766 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -104.65 148.96 25.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.767 0.317 . . . . 0.0 110.548 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -82.62 142.82 31.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.874 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.433 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.3 m -134.3 158.87 42.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.224 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 30.7 t -101.38 98.81 9.78 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.724 178.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.433 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 95.3 Cg_exo -42.99 145.4 1.17 Allowed 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.491 2.127 . . . . 0.0 112.681 -178.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.475 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 15.4 mttt -82.67 147.8 56.38 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.057 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 13.8 Cg_exo -74.18 160.69 42.09 Favored 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 123.394 2.729 . . . . 0.0 112.713 -179.121 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.53 151.31 46.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.668 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.81 120.99 7.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.096 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -99.48 158.47 15.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.419 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.2 ttt -133.62 132.46 40.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.026 0.441 . . . . 0.0 111.477 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.494 ' CE2' ' CD1' ' A' ' 9' ' ' PHE . 96.6 m-85 -138.93 146.25 40.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.367 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.414 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 6.1 t -121.96 133.76 54.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.948 0.404 . . . . 0.0 111.282 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.442 ' CD1' ' N ' ' A' ' 91' ' ' PHE . 3.3 m-85 -123.47 171.26 9.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.718 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -130.89 20.49 4.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.171 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 45.1 t-20 -152.1 113.98 4.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.812 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 -55.62 -31.74 62.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.914 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.03 -55.05 14.03 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.043 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.412 ' CG1' ' CA ' ' A' ' 5' ' ' GLY . 57.6 t -59.06 -47.68 89.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.338 179.449 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.436 ' HG3' ' CD1' ' A' ' 91' ' ' PHE . 16.4 ttp -64.46 -29.45 70.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.96 179.091 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -65.6 -34.08 77.41 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.403 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.4 ' O ' ' HB ' ' A' ' 103' ' ' THR . 60.2 m-80 -69.15 -40.44 78.2 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.591 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.428 ' CD1' HG21 ' A' ' 16' ' ' ILE . 24.3 mm -65.56 -52.12 54.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.739 179.68 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.07 -28.28 69.98 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.85 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 40.7 mtm -78.78 -40.81 32.13 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.66 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.431 HG21 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -75.52 -36.71 60.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.896 -179.97 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 13.5 mt -62.24 -40.37 95.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.876 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.32 -27.66 69.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.949 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -69.39 -40.36 77.44 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.996 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 4.0 mt -65.58 -44.99 93.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.296 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.401 ' O ' ' N ' ' A' ' 112' ' ' LYS . 2.1 mt -59.7 -61.0 1.66 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.608 0 CA-C-O 121.692 0.758 . . . . 0.0 109.259 179.057 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.5 t -50.97 -28.96 10.99 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.301 -1.318 . . . . 0.0 110.906 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 53.5 mtt-85 -68.48 -33.75 74.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.06 0.457 . . . . 0.0 110.576 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -105.44 -1.2 25.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.892 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.401 ' N ' ' O ' ' A' ' 108' ' ' ILE . 0.7 OUTLIER -108.19 -32.86 7.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.821 -179.847 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 87.1 m-20 -63.34 -35.46 80.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.737 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.02 -33.79 75.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.135 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 48.0 t0 . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.912 -179.995 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 58.3 mt . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.81 0.338 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.3 m -128.11 163.64 42.51 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.944 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -57.67 -38.48 93.15 Favored 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 122.686 2.257 . . . . 0.0 112.275 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -51.58 -23.61 4.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.84 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -65.86 -44.71 84.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.684 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.421 ' HA ' ' CD1' ' B' ' 53' ' ' TRP . 33.4 mm -69.92 -22.82 24.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.338 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -62.69 -32.43 73.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.928 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.88 -30.26 67.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.189 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' TRP . . . . . 0.448 ' CE3' ' CE ' ' A' ' 59' ' ' MET . 24.2 m95 -54.59 -27.1 36.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.762 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -110.25 -18.94 13.17 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.151 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -85.64 -42.6 14.17 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.745 0.307 . . . . 0.0 110.78 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -60.0 141.86 54.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.858 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -127.3 76.02 76.75 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.909 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo . . . . . 0 C--O 1.249 1.036 0 C-N-CA 122.645 2.23 . . . . 0.0 112.262 -179.949 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo . . . . . 0 N--CA 1.476 0.476 0 CA-C-O 120.814 0.256 . . . . 0.0 111.834 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.6 p -88.36 126.8 35.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.899 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.448 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 50.5 m80 65.74 35.76 6.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.094 0.473 . . . . 0.0 111.373 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.482 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 68.5 p -178.35 152.05 0.65 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.908 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.404 ' CA ' ' CG1' ' A' ' 96' ' ' VAL . . . 176.17 116.53 0.46 Allowed Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.139 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.581 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -46.77 104.35 0.05 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.146 0.498 . . . . 0.0 111.386 -179.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.459 ' O ' ' O ' ' A' ' 14' ' ' GLY . . . -119.26 152.4 36.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.753 -178.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.528 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.9 OUTLIER -100.63 125.76 54.4 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.267 0 CA-C-O 121.09 0.471 . . . . 0.0 110.469 179.0 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.506 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 4.3 t80 -113.3 130.78 56.17 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.125 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 81.8 mt-10 55.88 35.0 24.63 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.046 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 42.9 mtpt 75.78 1.49 3.55 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.362 -179.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.526 ' O ' HG21 ' A' ' 8' ' ' ILE . 41.0 t -99.8 155.46 4.14 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.616 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.528 ' HA ' HG13 ' A' ' 8' ' ' ILE . 71.9 p -98.44 148.58 23.57 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.572 0.701 . . . . 0.0 112.643 -178.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.459 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 175.86 -179.58 46.91 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 114.595 -1.184 . . . . 0.0 110.344 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.581 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.69 142.15 20.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 117.613 0.707 . . . . 0.0 110.465 179.344 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.482 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -106.68 118.45 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.766 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.561 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.405 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -119.3 137.79 53.45 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.234 -178.565 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.455 ' CD1' HG23 ' A' ' 103' ' ' THR . 64.8 mt -110.66 140.11 31.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.094 -179.101 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 -132.27 111.63 11.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.08 -179.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -91.14 3.44 54.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.2 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -78.81 -17.23 56.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.883 0.373 . . . . 0.0 110.469 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.87 141.66 16.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.941 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.405 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.3 t -114.37 116.58 43.94 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.747 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.411 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 1.6 Cg_endo -81.33 142.62 56.22 Favored 'Cis proline' 0 C--N 1.347 0.489 0 C-N-CA 123.818 -1.326 . . . . 0.0 111.904 -0.068 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.06 141.59 3.17 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.054 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -135.77 167.12 21.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.102 0.477 . . . . 0.0 111.739 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.5 tt -121.26 129.84 53.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.582 179.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.7 m -117.34 126.82 53.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.225 0.536 . . . . 0.0 112.156 -178.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.469 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 58.8 t90 -100.62 128.3 46.72 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.895 178.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.6 tpt180 -124.98 116.94 22.95 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.783 0.325 . . . . 0.0 111.065 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.442 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 12.5 m -45.49 166.23 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.01 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.75 -41.63 64.93 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.517 0.675 . . . . 0.0 109.526 179.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -84.66 -20.0 31.99 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.006 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.39 33.6 11.49 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.41 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -100.7 -22.85 14.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.658 0.266 . . . . 0.0 111.446 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 4.5 mtmt -130.23 137.56 50.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.777 0.322 . . . . 0.0 111.025 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 14.6 p -139.16 132.31 38.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.059 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.506 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 62.1 t60 -131.38 145.94 52.05 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.045 0.45 . . . . 0.0 111.222 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 48.5 m -129.12 134.48 48.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.025 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.9 t -126.71 140.81 47.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.031 0.443 . . . . 0.0 111.447 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.462 ' CG1' HG21 ' A' ' 44' ' ' THR . 1.9 p -85.54 117.55 30.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.446 ' HA ' HG12 ' A' ' 45' ' ' ILE . 83.6 mt -75.39 -31.69 60.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.244 -0.434 . . . . 0.0 112.097 -178.552 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.411 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 10.9 t -53.95 -23.36 12.76 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -179.072 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.462 HG21 ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -92.07 -21.24 20.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.716 0.293 . . . . 0.0 111.014 -179.736 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.446 HG12 ' HA ' ' A' ' 42' ' ' LEU . 36.4 mm -57.75 87.03 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.995 0.426 . . . . 0.0 111.067 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.416 ' N ' ' O ' ' A' ' 63' ' ' ILE . 21.8 t70 -64.77 -32.57 74.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.0 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.694 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 4.4 mmmt -142.67 149.7 39.22 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.055 0.455 . . . . 0.0 111.28 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.465 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -131.98 125.95 32.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.778 179.175 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -136.79 158.91 43.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.994 0.426 . . . . 0.0 111.431 -179.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -148.12 166.49 27.7 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.958 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.422 HG23 ' CE2' ' B' ' 54' ' ' PHE . 81.4 p -75.65 148.33 82.49 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.823 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.82 149.59 86.56 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.587 2.191 . . . . 0.0 112.362 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.82 -36.38 83.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.176 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.6 t -59.96 -26.29 65.88 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.994 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 24.1 t -86.62 117.09 25.16 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.918 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -56.98 -18.62 14.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.539 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.421 ' HD2' ' CE3' ' B' ' 53' ' ' TRP . 9.4 mttp -83.95 127.88 34.16 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.945 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.425 ' HE3' ' HA ' ' A' ' 92' ' ' ASN . 2.0 ttm -102.02 149.88 23.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.935 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.425 ' HE1' ' CE3' ' B' ' 53' ' ' TRP . 0.0 OUTLIER 178.38 138.91 0.09 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.914 0.388 . . . . 0.0 111.269 179.652 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.6 tp -126.1 123.92 39.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.122 179.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 20.8 mmt85 -110.14 123.56 49.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.929 0.395 . . . . 0.0 111.72 -179.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.438 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -109.25 128.07 54.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.372 179.466 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.694 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -105.63 122.69 59.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.576 -0.283 . . . . 0.0 110.986 179.871 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.89 -129.27 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.464 -0.874 . . . . 0.0 111.843 179.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.3 mttp -130.13 155.08 46.79 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.629 0.252 . . . . 0.0 110.516 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.471 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.2 p -118.78 -164.01 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.928 0.395 . . . . 0.0 111.243 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.471 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 21.1 t70 -178.94 75.66 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.186 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 55.7 mp0 -55.0 -22.49 15.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.446 -179.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 37.6 m -58.24 -18.34 25.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.127 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.2 -61.4 1.83 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.907 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp 62.96 94.4 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.94 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.6 mtt180 -97.15 141.49 30.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.984 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.4 ' HA ' ' HA ' ' A' ' 79' ' ' GLU . 55.8 mmtt -78.76 145.13 34.57 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.911 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.3 p30 -97.23 175.85 6.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.068 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -60.59 -19.68 58.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.333 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -87.08 7.48 27.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.512 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.78 13.7 80.4 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.738 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -111.01 145.42 38.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.825 0.345 . . . . 0.0 110.845 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.4 ' HA ' ' HA ' ' A' ' 73' ' ' LYS . 96.9 mt-10 -72.16 143.13 49.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.069 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.457 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 1.3 m -140.59 151.82 20.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.072 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.3 p -85.62 108.62 17.1 Favored Pre-proline 0 C--N 1.319 -0.745 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.62 178.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.457 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 46.0 Cg_exo -56.72 145.98 79.64 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.125 1.883 . . . . 0.0 112.257 -178.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 18.6 mtmt -83.12 148.12 55.62 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.034 0.445 . . . . 0.0 110.882 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo -74.28 158.71 44.64 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 C-N-CA 123.342 2.695 . . . . 0.0 112.695 -179.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.47 136.31 56.28 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.61 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 32.2 mtm105 -134.69 138.31 44.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.852 0.358 . . . . 0.0 111.214 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -118.15 157.03 27.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.358 179.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 8.5 ttt -133.58 120.48 20.79 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.95 0.405 . . . . 0.0 111.372 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.493 ' CE2' ' CD1' ' A' ' 9' ' ' PHE . 97.0 m-85 -126.24 133.05 51.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.574 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -106.09 133.63 50.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.885 0.374 . . . . 0.0 111.147 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.418 ' CZ ' ' HB1' ' A' ' 7' ' ' ALA . 2.5 m-85 -122.74 170.45 10.05 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.575 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.425 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 5.7 m120 -121.57 -22.83 5.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.801 0.334 . . . . 0.0 111.304 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -108.1 100.2 9.56 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.38 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -47.8 -30.16 3.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.111 0.481 . . . . 0.0 111.111 -179.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.45 -47.58 54.82 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.227 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.404 ' CG1' ' CA ' ' A' ' 5' ' ' GLY . 57.5 t -61.31 -50.22 81.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.395 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 41.8 ttp -62.49 -29.61 70.67 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 178.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -60.31 -34.49 73.86 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 121.098 0.475 . . . . 0.0 109.953 179.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -71.56 -33.68 69.31 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.891 178.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.457 HD12 ' CG2' ' A' ' 16' ' ' ILE . 19.6 mm -61.8 -47.83 91.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.586 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -67.47 -27.97 67.47 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.21 0.528 . . . . 0.0 110.357 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 77.5 mtp -78.55 -39.41 37.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.505 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.455 HG23 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -76.43 -40.54 50.39 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.714 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 18.9 mt -63.78 -36.83 85.19 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.85 0.357 . . . . 0.0 110.516 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -63.3 -29.37 70.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.973 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -68.98 -31.5 70.39 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.141 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 4.2 mt -76.49 -46.15 32.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.479 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . . . . . . . . . 2.2 mt -57.1 -61.38 1.28 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.568 0 CA-C-O 121.746 0.784 . . . . 0.0 109.544 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 18.2 t -50.27 -28.84 8.4 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.396 -1.275 . . . . 0.0 110.462 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.36 -35.01 79.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.671 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -89.55 -31.28 17.69 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.869 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.36 -41.17 94.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.956 0.408 . . . . 0.0 110.603 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -59.78 -37.35 78.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.926 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.94 -32.77 74.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.094 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.915 -179.99 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 40.0 mt . . . . . 0 N--CA 1.488 1.436 0 CA-C-O 120.879 0.371 . . . . 0.0 111.133 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.7 m -122.46 160.75 46.94 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.872 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_exo -52.25 -40.75 69.06 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.586 2.191 . . . . 0.0 112.347 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -56.65 -27.32 58.28 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.038 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -64.34 -43.12 95.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.852 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 37.9 mm -69.9 -27.15 31.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.195 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.72 -33.22 75.45 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.876 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.68 -28.91 69.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.052 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' TRP . . . . . 0.425 ' CE3' ' HE1' ' A' ' 59' ' ' MET . 11.9 m0 -55.21 -31.18 61.24 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.898 0.38 . . . . 0.0 110.913 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' PHE . . . . . 0.422 ' CE2' HG23 ' A' ' 51' ' ' THR . 71.5 m-85 -77.1 -34.97 56.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.02 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -82.21 -51.92 7.46 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.86 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -80.12 143.11 34.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.926 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -130.49 160.88 63.89 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.884 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo . . . . . 0 C--O 1.25 1.117 0 C-N-CA 122.594 2.196 . . . . 0.0 112.307 -179.978 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo . . . . . 0 N--CA 1.476 0.479 0 CA-C-O 120.808 0.253 . . . . 0.0 111.827 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.9 t 58.06 99.76 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.019 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 79.4 m80 64.16 33.44 11.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.234 0.54 . . . . 0.0 110.981 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.608 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 53.0 p 179.33 174.62 0.75 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.62 179.086 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 153.53 120.03 0.77 Allowed Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.466 -0.874 . . . . 0.0 112.522 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.58 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -47.21 105.76 0.07 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.151 0.501 . . . . 0.0 111.34 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.446 ' CB ' ' CE2' ' A' ' 91' ' ' PHE . . . -120.49 151.52 39.25 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.761 -178.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.542 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -99.67 124.26 52.94 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.256 0 CA-C-O 121.014 0.435 . . . . 0.0 110.29 179.046 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.495 ' CZ ' ' CD2' ' A' ' 38' ' ' HIS . 16.9 t80 -112.7 130.38 56.08 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.112 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.417 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 83.4 mt-10 56.4 34.21 23.79 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.037 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.0 mttm 76.24 1.35 3.39 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.249 -179.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.532 ' O ' HG21 ' A' ' 8' ' ' ILE . 40.6 t -99.71 154.42 4.26 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.671 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 178.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.542 ' HA ' HG13 ' A' ' 8' ' ' ILE . 78.0 p -97.31 148.47 23.1 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-O 121.604 0.716 . . . . 0.0 112.546 -178.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.436 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 175.59 -179.72 46.61 Favored Glycine 0 N--CA 1.447 -0.627 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.397 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.58 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.66 142.2 20.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 117.74 0.77 . . . . 0.0 110.521 179.369 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.608 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -106.69 118.56 54.64 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.758 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 179.557 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.474 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -121.3 134.46 55.15 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.315 -178.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.435 ' CD1' HG22 ' A' ' 103' ' ' THR . 96.7 mt -111.04 140.09 31.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.194 -179.158 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -128.72 112.65 14.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.004 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -87.36 6.16 34.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.267 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -78.34 -18.31 55.34 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.912 0.387 . . . . 0.0 110.411 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -100.39 146.76 8.57 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.859 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.5 t -121.51 115.5 31.07 Favored Pre-proline 0 CA--C 1.532 0.269 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.957 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.402 ' HB3' ' CB ' ' A' ' 43' ' ' SER . 5.6 Cg_exo -77.67 145.28 79.06 Favored 'Cis proline' 0 C--N 1.348 0.501 0 C-N-CA 123.633 -1.403 . . . . 0.0 111.842 -0.078 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -44.15 140.81 1.98 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.818 0.342 . . . . 0.0 110.916 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -124.69 157.72 34.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.132 0.491 . . . . 0.0 111.716 -179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.434 ' O ' ' HA ' ' A' ' 39' ' ' THR . 4.4 tt -121.28 128.9 52.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.494 179.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.9 m -119.63 125.79 49.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.143 0.496 . . . . 0.0 112.168 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.473 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 60.2 t90 -100.49 127.79 46.74 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.727 178.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 44.8 ttp85 -122.0 117.15 25.68 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.798 0.333 . . . . 0.0 111.013 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.429 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 64.0 m -46.66 162.93 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.913 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.83 -41.57 68.0 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.536 0.684 . . . . 0.0 109.551 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -82.14 -21.14 36.78 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.803 -1.09 . . . . 0.0 111.044 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.09 34.48 12.64 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.329 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 51.9 t0 -104.0 -19.4 14.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.615 0.245 . . . . 0.0 111.614 -179.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.57 142.17 45.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.888 0.375 . . . . 0.0 111.327 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 48.6 t -139.26 138.05 40.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.925 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.495 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 50.9 t60 -134.55 145.77 49.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.207 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.434 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 43.5 m -129.31 134.86 48.12 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.175 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 90.8 t -135.04 139.69 46.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 CA-C-O 121.127 0.489 . . . . 0.0 111.836 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.481 ' CG1' HG23 ' A' ' 44' ' ' THR . 1.6 p -88.63 117.46 32.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.505 177.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.49 ' HA ' HG12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -73.95 -28.28 61.43 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -179.035 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.417 ' HB2' ' CE2' ' A' ' 111' ' ' TYR . 11.9 t -55.96 -21.59 21.77 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.157 0.429 . . . . 0.0 112.157 -179.161 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.481 HG23 ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -96.54 -21.9 17.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.833 0.349 . . . . 0.0 111.413 -179.446 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.49 HG12 ' HA ' ' A' ' 42' ' ' LEU . 47.6 mm -53.18 94.19 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.028 0.442 . . . . 0.0 111.053 -179.751 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -61.15 -28.87 69.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.393 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.609 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 16.3 mttm -153.41 162.92 40.78 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.167 0.508 . . . . 0.0 111.603 -179.711 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 22.2 mt -123.88 124.36 42.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.362 179.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.441 ' NE2' ' CG ' ' B' ' 54' ' ' PHE . 63.5 tt0 -111.07 130.34 55.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.621 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.81 138.84 25.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.218 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.413 HG21 ' CE2' ' B' ' 54' ' ' PHE . 57.2 p -75.75 122.05 86.29 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.496 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -62.6 160.54 31.83 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.563 2.175 . . . . 0.0 112.49 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.92 -43.14 91.06 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.131 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.2 m -60.85 -27.71 68.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.06 0.457 . . . . 0.0 110.63 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 26.3 t -79.48 122.03 25.93 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.97 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -56.61 -18.74 13.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.284 179.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.404 ' HG3' ' CE3' ' B' ' 53' ' ' TRP . 12.1 mptt -65.46 151.83 45.4 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.72 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.505 ' HE1' ' HA ' ' A' ' 92' ' ' ASN . 48.5 mtp -143.0 79.82 1.66 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.98 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.44 ' HE1' ' CE3' ' B' ' 53' ' ' TRP . 0.9 OUTLIER -155.71 169.02 25.32 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.016 0.436 . . . . 0.0 111.569 -179.783 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -135.85 126.82 27.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.147 179.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.421 ' HD3' ' CE1' ' B' ' 54' ' ' PHE . 32.8 mtp180 -119.06 129.9 55.34 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.93 0.395 . . . . 0.0 111.657 -179.342 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.468 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.1 141.81 36.85 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.397 179.613 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.609 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.1 mm -105.15 112.84 40.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.687 0.279 . . . . 0.0 111.326 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -83.82 125.36 7.03 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.605 -0.807 . . . . 0.0 112.36 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 50.6 mttt -49.46 153.6 1.07 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.826 0.346 . . . . 0.0 111.185 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.439 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.3 p -117.65 -161.9 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.061 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.439 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 23.5 m-20 -167.37 62.21 0.08 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.496 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -49.58 -28.27 5.47 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.402 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 36.9 m -54.44 -18.83 4.66 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.118 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.7 mmtp -62.44 -37.3 85.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.858 0.361 . . . . 0.0 110.988 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.6 mptt 61.37 93.48 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.864 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 -104.72 157.3 17.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.861 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -111.27 145.5 38.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.896 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 35.7 p30 -93.07 174.45 7.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.987 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -62.14 -18.36 60.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.393 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -86.95 7.98 25.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.556 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.93 11.25 81.23 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.718 -0.754 . . . . 0.0 112.694 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -106.55 146.09 31.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.844 0.354 . . . . 0.0 110.709 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -73.77 148.83 42.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.971 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.456 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.4 m -136.11 159.05 38.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.982 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.9 t -100.54 98.74 8.54 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.701 178.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.456 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 79.8 Cg_exo -44.17 145.13 2.42 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.402 2.068 . . . . 0.0 112.789 -179.085 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.417 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 8.6 mtmt -95.11 151.05 38.53 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.879 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 18.0 Cg_exo -71.4 143.43 43.14 Favored 'Trans proline' 0 N--CA 1.465 -0.198 0 C-N-CA 123.48 2.786 . . . . 0.0 112.746 -178.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.1 mm-40 -65.37 151.47 46.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.02 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 90.5 mtt180 -148.79 119.78 7.68 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.565 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -98.71 150.88 21.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.759 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -128.47 122.23 30.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.13 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.455 ' CE2' ' CD1' ' A' ' 9' ' ' PHE . 93.2 m-85 -127.2 155.1 43.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.604 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 35.7 t -129.35 134.96 48.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.906 0.384 . . . . 0.0 110.953 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.446 ' CD1' ' N ' ' A' ' 91' ' ' PHE . 3.0 m-85 -127.48 147.99 50.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.685 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.505 ' HA ' ' HE1' ' A' ' 58' ' ' MET . 47.6 m-20 -95.33 -24.03 16.92 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.242 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -106.59 115.53 30.35 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.806 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -57.29 -31.28 65.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.936 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.02 -45.06 90.58 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.233 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 57.4 t -58.24 -44.19 87.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.754 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.429 ' HG2' ' CG ' ' A' ' 91' ' ' PHE . 3.2 mtm -60.72 -32.24 71.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.316 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 48.8 t0 -64.06 -29.98 71.09 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.881 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -80.89 -50.17 10.1 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.02 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.426 ' CD1' HG23 ' A' ' 16' ' ' ILE . 23.5 mm -58.68 -52.26 62.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.005 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -61.16 -32.08 71.81 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.952 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 33.4 mtm -78.86 -40.36 32.76 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.166 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.435 HG22 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -72.16 -41.32 67.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.275 -179.552 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 12.5 mt -64.05 -38.42 91.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.789 0.328 . . . . 0.0 110.775 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -65.61 -28.81 69.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.764 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -68.52 -35.94 78.16 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.673 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 57.8 mt -68.35 -46.7 80.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.081 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.443 ' H ' HG13 ' A' ' 108' ' ' ILE . 2.2 mt -59.02 -61.12 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.508 -0.637 0 CA-C-O 121.809 0.814 . . . . 0.0 109.218 179.099 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 8.5 t -50.53 -28.72 9.07 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.379 -1.282 . . . . 0.0 110.434 179.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.45 -48.94 68.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.412 0.625 . . . . 0.0 109.841 179.336 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.417 ' CE2' ' HB2' ' A' ' 43' ' ' SER . 39.4 m-85 -75.36 -28.99 59.77 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.291 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 11.4 mttm -63.83 -47.95 78.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.662 179.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -62.78 -38.82 92.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.942 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.9 -34.94 79.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.127 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.16 -0.924 . . . . 0.0 110.899 179.959 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 49.7 mt . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.813 0.34 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 9.8 t -129.6 151.49 78.11 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.941 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -52.63 -30.27 44.84 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.479 2.119 . . . . 0.0 112.359 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -55.5 -22.95 23.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.115 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -81.61 -38.38 26.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.262 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.453 HG21 HD13 ' B' ' 50' ' ' ILE . 34.6 mm -78.39 -28.34 14.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.759 -179.457 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -69.44 -30.64 68.61 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.917 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.09 -28.92 67.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.903 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' TRP . . . . . 0.44 ' CE3' ' HE1' ' A' ' 59' ' ' MET . 10.2 m0 -54.1 -36.4 63.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.959 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' PHE . . . . . 0.441 ' CG ' ' NE2' ' A' ' 49' ' ' GLN . 91.2 m-85 -83.82 -26.96 29.12 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.992 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.38 -34.63 61.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.765 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 44.68 -166.17 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.408 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -122.05 160.94 45.21 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.862 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo . . . . . 0 C--O 1.249 1.042 0 C-N-CA 122.568 2.179 . . . . 0.0 112.325 179.964 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo . . . . . 0 N--CA 1.475 0.436 0 CA-C-O 120.882 0.284 . . . . 0.0 111.708 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.1 m -165.93 -76.93 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.892 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.405 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 54.8 m80 -113.05 34.0 4.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.164 0.507 . . . . 0.0 111.046 -179.722 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.487 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 36.5 p -170.48 145.42 2.61 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.547 179.137 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -177.69 116.91 0.56 Allowed Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.375 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.581 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -45.65 105.15 0.06 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.094 0.473 . . . . 0.0 111.437 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.453 ' O ' ' O ' ' A' ' 14' ' ' GLY . . . -120.59 151.42 39.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.905 -178.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.543 HG21 ' O ' ' A' ' 12' ' ' VAL . 0.8 OUTLIER -100.3 124.55 53.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.998 0.428 . . . . 0.0 110.425 179.145 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.501 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 11.1 t80 -112.79 130.58 56.03 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.179 179.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 56.14 34.24 23.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.007 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 25.8 mttp 76.38 1.06 3.32 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.334 -179.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.543 ' O ' HG21 ' A' ' 8' ' ' ILE . 41.7 t -99.35 154.93 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.633 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 178.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.534 ' HA ' HG13 ' A' ' 8' ' ' ILE . 98.1 p -98.05 148.72 23.23 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-O 121.67 0.748 . . . . 0.0 112.794 -178.647 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.453 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 175.52 -179.79 46.51 Favored Glycine 0 N--CA 1.446 -0.672 0 CA-C-N 114.452 -1.249 . . . . 0.0 110.285 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.581 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.61 143.13 17.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 117.688 0.744 . . . . 0.0 110.403 179.372 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.487 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -106.58 118.26 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 CA-C-N 115.335 -0.848 . . . . 0.0 108.767 179.575 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -121.52 124.58 44.75 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.2 0.524 . . . . 0.0 111.389 -178.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.441 ' CD1' HG21 ' A' ' 103' ' ' THR . 53.6 mt -94.52 140.03 17.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.903 -179.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -127.37 111.53 13.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.079 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -95.81 5.39 51.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.239 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -79.71 -17.4 53.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.962 0.41 . . . . 0.0 110.538 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -102.96 145.39 12.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.938 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.4 t -119.67 116.41 33.24 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.86 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -77.81 144.44 76.5 Favored 'Cis proline' 0 C--N 1.348 0.552 0 C-N-CA 123.491 -1.462 . . . . 0.0 112.332 0.09 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -50.7 151.4 2.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.88 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -137.62 165.75 25.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.201 0.524 . . . . 0.0 111.838 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.8 tt -121.24 121.98 38.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.325 179.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 41.0 m -112.56 124.93 53.64 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.47 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 56.3 t90 -100.65 127.74 46.95 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.875 178.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.17 118.33 27.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.852 0.358 . . . . 0.0 111.195 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 25.5 t -46.04 167.76 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.047 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.46 -42.43 59.07 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.481 0.658 . . . . 0.0 109.677 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 89.7 m-20 -89.11 -17.02 30.1 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.771 -1.104 . . . . 0.0 111.109 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.94 33.35 11.09 Favored Glycine 0 C--N 1.332 0.359 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.362 -179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -95.46 -22.15 17.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.594 0.235 . . . . 0.0 111.492 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.6 143.08 37.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.826 0.346 . . . . 0.0 111.365 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 14.5 p -139.24 137.62 41.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.893 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.501 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 30.2 t60 -131.28 145.64 51.97 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.97 0.414 . . . . 0.0 111.218 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 40.9 m -129.09 136.03 49.69 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.959 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.401 HG11 ' N ' ' A' ' 41' ' ' VAL . 77.5 t -130.07 141.73 45.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.235 0.54 . . . . 0.0 111.788 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.405 ' HB ' ' CG2' ' A' ' 44' ' ' THR . 0.0 OUTLIER -85.31 118.11 31.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.649 178.029 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.411 ' CD1' ' CD1' ' A' ' 107' ' ' ILE . 27.6 mt -66.89 -19.55 65.75 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.804 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.5 t -67.76 -25.43 65.62 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.799 179.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.432 ' O ' ' N ' ' A' ' 65' ' ' LYS . 0.1 OUTLIER -87.1 -37.68 17.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.825 179.864 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.486 HG22 ' CB ' ' A' ' 62' ' ' LEU . 8.9 mm -58.31 87.99 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.492 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -83.96 -25.53 29.97 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.77 -178.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.527 ' HB2' HG12 ' A' ' 63' ' ' ILE . 13.6 mttp -125.17 158.0 35.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.21 0.529 . . . . 0.0 111.902 -179.098 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.421 HD12 ' N ' ' A' ' 105' ' ' GLN . 28.8 mt -131.44 128.84 40.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.556 179.168 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.428 ' HG2' ' CD2' ' B' ' 54' ' ' PHE . 35.8 tt0 -129.54 130.38 45.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.885 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.51 137.66 28.65 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.019 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.449 ' CG2' ' CE2' ' B' ' 54' ' ' PHE . 31.6 p -75.67 126.24 87.53 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.8 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.43 160.74 46.44 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.509 2.139 . . . . 0.0 112.449 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.96 -42.95 81.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.11 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.0 m -61.5 -27.64 68.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.052 0.453 . . . . 0.0 110.697 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.3 m -77.48 121.68 24.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.879 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -56.22 -18.82 11.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.322 179.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.54 140.88 42.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.774 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.443 ' HE1' ' HA ' ' A' ' 92' ' ' ASN . 33.3 mtp -130.89 79.92 1.92 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.737 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.434 ' HE1' ' CE3' ' B' ' 53' ' ' TRP . 0.7 OUTLIER -150.83 168.75 23.49 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.135 0.493 . . . . 0.0 111.579 -179.683 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.437 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.3 OUTLIER -137.84 123.78 20.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.973 179.474 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.419 ' O ' ' N ' ' A' ' 49' ' ' GLN . 40.4 ttt180 -127.93 136.78 51.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.795 0.331 . . . . 0.0 111.689 -179.238 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.486 ' CB ' HG22 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -119.41 144.09 47.12 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.443 179.227 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.527 HG12 ' HB2' ' A' ' 47' ' ' LYS . 1.1 mm -101.08 134.23 41.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.827 0.346 . . . . 0.0 110.986 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -82.73 153.22 31.13 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.186 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.432 ' N ' ' O ' ' A' ' 44' ' ' THR . 38.4 mttt -60.12 163.13 5.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.709 0.29 . . . . 0.0 110.735 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.49 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.4 p -116.9 -163.43 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 121.018 0.437 . . . . 0.0 111.279 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.49 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 56.0 m-20 -160.59 71.14 0.43 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.092 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -55.51 -20.9 14.36 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.534 -179.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 31.0 m -53.71 -21.69 7.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.797 0.332 . . . . 0.0 111.124 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.8 mtmm -76.32 -48.71 19.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.965 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 60.66 92.83 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.949 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 10.9 mtm180 -94.48 129.25 41.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.824 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.405 ' HA ' ' HA ' ' A' ' 79' ' ' GLU . 29.1 mmtp -81.21 145.3 31.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.045 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -92.65 179.83 5.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.955 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -64.93 -18.84 65.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.333 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -87.82 -2.84 58.87 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.274 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.69 8.23 73.77 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.699 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 22.7 p30 -105.58 145.99 30.24 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.883 0.373 . . . . 0.0 110.93 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.405 ' HA ' ' HA ' ' A' ' 73' ' ' LYS . 49.5 mt-10 -71.83 143.78 49.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.92 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.437 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.8 m -138.86 158.77 30.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.165 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 37.4 t -83.88 110.22 24.01 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.437 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 88.3 Cg_exo -46.8 169.67 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.217 1.944 . . . . 0.0 112.758 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.484 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.1 OUTLIER -90.4 95.88 0.81 Allowed Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.215 -179.873 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.484 ' HD2' ' HA ' ' A' ' 83' ' ' LYS . 7.9 Cg_endo -46.53 161.45 0.18 Allowed 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 123.41 2.74 . . . . 0.0 112.363 179.289 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -65.48 159.92 23.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.655 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -155.23 133.15 11.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.24 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -118.52 133.3 55.98 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.314 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 22.7 ttt -113.95 137.29 51.88 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.986 0.422 . . . . 0.0 111.47 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.446 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 99.0 m-85 -139.27 151.22 46.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.486 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -123.27 135.24 54.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.893 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.442 ' CD1' ' N ' ' A' ' 91' ' ' PHE . 2.8 m-85 -128.42 160.31 32.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.951 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.443 ' HA ' ' HE1' ' A' ' 58' ' ' MET . 68.4 m-20 -110.64 9.96 22.89 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.277 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -141.64 107.75 5.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.636 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.9 tmm_? -49.02 -30.28 5.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.272 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.56 -55.11 6.73 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.451 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 56.4 t -55.39 -48.17 77.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.873 0.368 . . . . 0.0 110.707 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.42 ' HB3' ' CG ' ' A' ' 91' ' ' PHE . 15.4 ptm -63.82 -38.03 89.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.917 179.148 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -61.47 -34.36 75.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.365 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -66.92 -41.45 87.06 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.631 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.416 HD12 ' CG2' ' A' ' 16' ' ' ILE . 27.2 mm -60.69 -52.37 62.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.853 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.16 -27.87 67.65 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.254 179.534 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 39.7 mtm -78.11 -36.89 47.43 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.72 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.441 HG21 ' CD1' ' A' ' 18' ' ' ILE . 0.5 OUTLIER -79.47 -39.85 31.21 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.497 179.815 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 28.1 mt -59.99 -35.69 75.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.764 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.421 ' N ' HD12 ' A' ' 48' ' ' LEU . 1.9 mt-30 -61.39 -32.18 72.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.796 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -65.64 -28.17 68.91 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.076 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.411 ' CD1' ' CD1' ' A' ' 42' ' ' LEU . 3.1 mt -81.11 -44.14 20.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.634 -179.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.402 HD12 HD12 ' A' ' 48' ' ' LEU . 2.2 mt -58.19 -61.35 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.585 0 CA-C-O 121.603 0.716 . . . . 0.0 109.444 179.402 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.7 p -49.08 -31.14 7.37 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.48 -1.236 . . . . 0.0 110.366 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -61.78 -41.8 98.18 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.568 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -85.3 -29.07 24.85 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.428 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 11.6 mttm -62.11 -42.0 98.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.524 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -53.96 -37.14 63.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.061 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.02 -33.61 75.8 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.062 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 52.1 t0 . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.276 -0.868 . . . . 0.0 110.922 -179.961 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 60.6 mt . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.92 0.39 . . . . 0.0 111.219 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.3 m -128.98 163.81 43.15 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.793 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -53.94 -41.85 71.59 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.588 2.192 . . . . 0.0 112.289 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -55.79 -22.53 24.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.816 179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -66.83 -49.43 65.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.759 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 41.4 mm -65.11 -24.72 35.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.175 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -63.69 -33.23 75.17 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.813 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -69.18 -31.04 69.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.966 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' TRP . . . . . 0.434 ' CE3' ' HE1' ' A' ' 59' ' ' MET . 15.0 m95 -54.99 -24.85 26.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.728 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' PHE . . . . . 0.449 ' CE2' ' CG2' ' A' ' 51' ' ' THR . 13.0 m-85 -115.39 -11.42 11.87 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.314 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -93.76 -29.75 15.21 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.712 0.291 . . . . 0.0 111.0 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -60.78 -37.71 82.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.949 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 10.4 t70 55.49 83.99 0.22 Allowed Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.147 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_exo . . . . . 0 C--O 1.25 1.093 0 C-N-CA 122.529 2.153 . . . . 0.0 112.431 179.936 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo . . . . . 0 N--CA 1.475 0.432 0 CA-C-O 120.745 0.227 . . . . 0.0 111.89 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 57.22 106.52 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.08 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 75.6 m80 63.93 31.9 13.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.195 0.521 . . . . 0.0 111.042 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.627 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 88.4 p 178.15 172.7 0.66 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.744 178.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.407 ' CA ' ' CG1' ' A' ' 96' ' ' VAL . . . 154.64 116.32 0.57 Allowed Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.746 -0.74 . . . . 0.0 111.966 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.554 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -40.39 117.56 0.82 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.846 0.355 . . . . 0.0 111.144 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.495 ' HB1' ' HB ' ' A' ' 16' ' ' ILE . . . -132.67 149.7 52.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.844 -178.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.562 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.1 mp -97.46 124.2 50.25 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 CA-C-O 121.023 0.44 . . . . 0.0 110.528 179.282 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.506 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 10.1 t80 -115.8 129.4 56.42 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.927 179.658 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 58.71 33.91 23.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.794 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.0 mttp 75.63 1.64 3.62 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.142 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.481 ' O ' HG23 ' A' ' 8' ' ' ILE . 32.7 t -100.94 151.42 5.34 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.694 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.562 ' HA ' HG13 ' A' ' 8' ' ' ILE . 85.3 p -90.36 145.89 24.6 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 121.435 0.636 . . . . 0.0 111.678 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.435 ' O ' ' N ' ' A' ' 7' ' ' ALA . . . -176.64 -179.22 46.96 Favored Glycine 0 N--CA 1.444 -0.817 0 CA-C-N 114.979 -1.009 . . . . 0.0 111.691 -179.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.554 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.9 mm -105.61 137.52 35.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 121.034 0.445 . . . . 0.0 110.194 179.667 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.627 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -106.54 117.92 53.24 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.672 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.538 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -124.4 131.07 53.5 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.366 -177.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.421 ' CD1' HG21 ' A' ' 103' ' ' THR . 89.0 mt -106.45 140.04 25.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.27 -179.261 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -132.25 112.49 12.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.971 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -90.95 6.14 45.85 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.215 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -79.44 -17.53 54.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.872 0.368 . . . . 0.0 110.529 179.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -100.2 143.27 14.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.972 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.9 t -115.15 116.26 42.36 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.821 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -80.52 143.64 64.55 Favored 'Cis proline' 0 C--N 1.349 0.576 0 C-N-CA 123.701 -1.374 . . . . 0.0 111.928 -0.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.21 141.3 4.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.732 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 68.4 mt-10 -134.5 166.24 23.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.172 0.51 . . . . 0.0 111.877 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.5 tt -121.33 127.58 51.43 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.555 179.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 41.0 m -116.6 129.61 56.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.212 0.53 . . . . 0.0 112.13 -178.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.481 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 56.3 t90 -100.47 125.69 46.81 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.984 178.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -122.61 117.3 25.52 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.71 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 30.3 t -44.48 158.96 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.752 0.311 . . . . 0.0 110.88 -179.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.424 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -66.42 -39.48 88.97 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 121.616 0.722 . . . . 0.0 109.352 179.9 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 42.8 p30 -89.46 -18.93 25.78 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.296 179.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.04 32.0 11.3 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.672 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -99.29 -18.88 17.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.725 0.297 . . . . 0.0 111.467 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.8 mtmt -134.97 140.6 45.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.089 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.2 t -139.11 137.09 42.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.897 0.38 . . . . 0.0 111.294 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.506 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 82.5 t60 -137.7 146.3 43.6 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.088 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 47.8 m -129.07 138.0 51.6 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.216 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.5 t -132.15 140.87 46.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 121.095 0.474 . . . . 0.0 111.421 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.454 ' CG1' HG23 ' A' ' 44' ' ' THR . 2.3 p -86.02 117.84 31.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.051 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.448 ' HA ' HG12 ' A' ' 45' ' ' ILE . 78.7 mt -75.47 -31.2 60.17 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.095 0.405 . . . . 0.0 112.095 -178.539 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 58.3 p -55.63 -21.86 19.81 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.122 0.415 . . . . 0.0 112.122 -178.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.454 HG23 ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -96.28 -21.84 17.59 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.756 0.312 . . . . 0.0 111.271 -179.785 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.455 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 38.0 mm -50.19 95.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.059 0.457 . . . . 0.0 111.039 -179.755 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -67.68 -27.94 67.26 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.317 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.593 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 38.4 mttm -156.72 159.89 38.79 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.045 0.45 . . . . 0.0 111.569 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -131.73 128.16 38.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.777 179.357 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -119.59 141.02 49.65 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.937 0.399 . . . . 0.0 111.071 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.85 143.25 31.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.992 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 43.0 p -75.7 111.21 13.33 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.597 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -64.56 160.59 39.09 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.559 2.173 . . . . 0.0 112.621 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.21 -41.84 72.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.186 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.0 m -58.12 -27.54 63.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.115 0.484 . . . . 0.0 110.788 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 31.4 t -86.29 118.65 25.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.817 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -57.18 -18.36 15.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.476 179.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.417 ' HD2' ' CD2' ' B' ' 53' ' ' TRP . 71.4 mmtt -72.95 145.64 46.62 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.061 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.44 ' HE1' ' HA ' ' A' ' 92' ' ' ASN . 59.1 mtp -129.9 95.13 3.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.583 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 3.1 tmm? -175.36 148.65 0.96 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.053 0.454 . . . . 0.0 111.266 -179.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.419 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -114.32 145.7 41.45 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.368 179.694 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.428 ' HB2' ' CZ ' ' B' ' 54' ' ' PHE . 16.1 mtt-85 -130.88 131.68 44.68 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.004 0.43 . . . . 0.0 111.726 -179.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.452 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -111.48 142.06 44.25 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.361 179.41 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.593 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.6 mm -103.51 150.17 7.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.746 0.308 . . . . 0.0 110.8 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -114.32 134.72 11.92 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.234 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 19.8 mttt -54.33 147.07 14.17 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.75 0.31 . . . . 0.0 110.877 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.446 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.2 p -115.0 -162.98 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.346 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.446 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 52.1 t0 -178.69 76.58 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.102 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -53.71 -23.83 12.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.424 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 42.3 m -61.93 -15.39 42.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.104 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.5 mmtp -64.02 -45.09 90.48 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.753 0.311 . . . . 0.0 111.067 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.9 mmtt 64.09 95.83 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.893 0.377 . . . . 0.0 110.79 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 26.1 mmt85 -106.54 146.99 29.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.849 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -104.04 145.16 30.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.966 0.413 . . . . 0.0 110.969 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 43.6 p30 -87.6 176.91 7.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.991 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -65.1 -16.97 64.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.357 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -86.43 6.66 29.22 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.518 -179.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.16 9.65 86.68 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.759 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.2 m-80 -101.31 161.15 13.83 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.763 0.316 . . . . 0.0 110.775 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -90.51 150.42 21.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.887 0.375 . . . . 0.0 110.927 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.462 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.7 m -140.5 158.72 24.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.167 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 20.4 t -86.72 108.89 20.16 Favored Pre-proline 0 C--N 1.326 -0.45 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 178.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.462 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 78.2 Cg_exo -50.23 145.29 20.94 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.111 1.874 . . . . 0.0 112.466 -178.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.462 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 7.4 mtpt -110.66 151.56 42.9 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.054 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 15.1 Cg_exo -73.41 155.03 50.98 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 C-N-CA 123.589 2.859 . . . . 0.0 112.642 -178.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -87.13 155.35 20.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.413 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 18.4 ttp180 -141.79 119.72 11.97 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.749 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 13.0 m-70 -94.64 136.33 35.06 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.221 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -120.48 112.14 18.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.914 0.388 . . . . 0.0 111.541 -179.5 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.506 ' CE2' ' CD1' ' A' ' 9' ' ' PHE . 86.4 m-85 -118.12 125.19 49.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.156 179.16 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -95.06 128.8 42.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.968 0.413 . . . . 0.0 111.236 -179.502 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.463 ' CE2' ' HB1' ' A' ' 7' ' ' ALA . 75.2 m-85 -113.44 145.55 40.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.81 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.44 ' HA ' ' HE1' ' A' ' 58' ' ' MET . 7.2 m120 -107.75 25.3 11.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.911 179.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -151.91 108.6 3.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.519 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 24.3 mtm-85 -52.0 -29.38 20.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.231 -179.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.12 -54.99 5.83 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.464 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.407 ' CG1' ' CA ' ' A' ' 5' ' ' GLY . 46.0 t -54.25 -47.14 68.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.813 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.39 -34.36 75.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.964 0.412 . . . . 0.0 110.21 179.337 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.411 ' O ' ' HB3' ' A' ' 102' ' ' MET . 50.6 t0 -63.63 -33.61 76.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.78 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 38.2 m-80 -67.45 -36.96 82.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.168 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.446 HG13 ' CZ ' ' A' ' 91' ' ' PHE . 22.8 mm -66.31 -49.22 77.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.739 179.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.27 -27.52 68.69 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.726 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.411 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -78.71 -40.91 32.36 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.165 179.654 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.421 HG21 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -74.23 -39.6 62.96 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.755 -179.898 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 13.2 mt -62.01 -41.03 97.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.714 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -62.95 -27.28 69.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.994 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -70.47 -32.01 69.37 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.96 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 5.8 mt -75.93 -46.19 35.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.504 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.413 ' H ' HG13 ' A' ' 108' ' ' ILE . 2.0 mt -56.67 -61.34 1.25 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.585 0 CA-C-O 121.742 0.782 . . . . 0.0 109.635 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 11.5 t -51.0 -28.8 10.74 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.43 -1.259 . . . . 0.0 110.373 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.37 -40.13 95.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.344 179.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -84.14 -29.81 26.39 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.28 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 9.7 mttm -63.04 -43.59 98.24 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.496 179.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -58.48 -36.56 73.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.948 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.03 -32.87 74.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.107 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 . . . . . 0 C--O 1.248 0.993 0 CA-C-O 118.167 -0.921 . . . . 0.0 110.883 -179.975 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 7.9 mp . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.918 0.389 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -127.02 157.42 72.08 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.829 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_exo -52.02 -39.61 69.44 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.601 2.201 . . . . 0.0 112.342 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 93.3 m-20 -57.58 -26.72 61.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.846 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -77.58 -43.08 32.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.318 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 33.0 mm -70.64 -31.98 47.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.801 -179.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -73.1 -28.5 62.32 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.03 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -66.5 -24.2 66.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.131 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 53' ' ' TRP . . . . . 0.417 ' CD2' ' HD2' ' A' ' 57' ' ' LYS . 17.6 m0 -51.86 -29.75 20.9 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.038 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 54' ' ' PHE . . . . . 0.428 ' CZ ' ' HB2' ' A' ' 61' ' ' ARG . 89.2 m-85 -95.8 -25.66 15.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.122 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -78.65 -29.72 45.94 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.866 0.365 . . . . 0.0 110.856 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -79.69 132.93 36.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.998 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -129.16 77.12 78.23 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.932 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo . . . . . 0 C--O 1.249 1.045 0 C-N-CA 122.485 2.123 . . . . 0.0 112.387 179.981 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo . . . . . 0 N--CA 1.476 0.46 0 CA-C-O 120.91 0.296 . . . . 0.0 111.943 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.5 p -76.37 -12.12 60.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.377 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.412 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 74.5 m80 -153.03 36.0 0.48 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.154 0.502 . . . . 0.0 110.917 -179.71 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.471 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 11.7 p -175.04 134.21 0.33 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.649 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -162.2 119.29 0.87 Allowed Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.417 179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.605 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -43.86 106.12 0.06 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.204 0.526 . . . . 0.0 111.298 -179.612 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.438 ' HB2' ' HB ' ' A' ' 16' ' ' ILE . . . -120.15 152.08 38.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.916 -178.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.526 HG23 ' O ' ' A' ' 12' ' ' VAL . 0.8 OUTLIER -100.1 124.79 53.78 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.252 0 CA-C-O 120.959 0.409 . . . . 0.0 110.241 178.876 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.498 ' CZ ' ' CD2' ' A' ' 38' ' ' HIS . 27.3 t80 -112.25 130.43 55.93 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.19 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.425 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 88.9 mt-10 55.24 34.83 23.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.906 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.9 mtpt 76.1 1.3 3.43 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.353 -179.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.526 ' O ' HG23 ' A' ' 8' ' ' ILE . 41.4 t -99.38 154.98 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.643 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.517 ' HA ' HG13 ' A' ' 8' ' ' ILE . 90.4 p -96.65 148.96 22.33 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-O 121.562 0.696 . . . . 0.0 112.595 -178.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.436 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 175.31 -179.68 46.39 Favored Glycine 0 N--CA 1.445 -0.749 0 CA-C-N 114.569 -1.196 . . . . 0.0 110.181 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.605 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.9 143.19 18.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 117.632 0.716 . . . . 0.0 110.637 179.47 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.486 HG21 HD12 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -106.76 118.63 54.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 179.571 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -119.03 129.13 54.95 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.168 0.508 . . . . 0.0 111.409 -178.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.448 ' CD1' HG21 ' A' ' 103' ' ' THR . 54.0 mt -102.9 140.07 22.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.934 -179.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 47.2 t-20 -132.48 111.42 11.26 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.913 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -93.23 4.64 53.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.247 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -78.95 -17.55 55.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.004 0.43 . . . . 0.0 110.437 179.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.64 140.75 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.92 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.5 t -112.94 116.93 46.93 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.767 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.4 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 1.1 Cg_endo -81.5 142.68 55.46 Favored 'Cis proline' 0 C--N 1.347 0.493 0 C-N-CA 123.878 -1.301 . . . . 0.0 112.054 0.082 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.58 142.85 5.53 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.88 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 72.9 mt-10 -136.03 167.19 21.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.126 0.489 . . . . 0.0 111.552 -179.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.3 tt -121.15 129.14 53.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.854 179.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.5 m -117.05 127.64 54.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.105 0.479 . . . . 0.0 112.011 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.492 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 57.0 t90 -100.57 130.05 46.58 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.111 179.151 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.5 ttt180 -124.97 116.29 21.93 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.938 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.408 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 10.6 m -45.45 163.85 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.042 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.88 -41.5 67.94 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 121.497 0.665 . . . . 0.0 109.551 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.2 t0 -83.3 -20.74 33.86 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.046 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.26 34.3 12.66 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.34 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -100.99 -21.24 15.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.572 0.225 . . . . 0.0 111.505 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.41 144.23 46.41 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.931 0.396 . . . . 0.0 111.329 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 11.7 p -139.4 137.76 40.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.011 179.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.498 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 13.6 t60 -132.31 145.53 51.34 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.859 0.361 . . . . 0.0 111.169 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 45.2 m -129.16 135.58 49.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.998 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.404 HG12 ' CD2' ' A' ' 87' ' ' HIS . 97.4 t -130.07 140.95 47.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.007 0.432 . . . . 0.0 111.642 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.462 ' CG2' HG23 ' A' ' 44' ' ' THR . 7.0 p -87.99 117.47 31.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.367 178.364 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.41 ' CD1' ' CD1' ' A' ' 107' ' ' ILE . 18.7 mt -76.02 -33.26 59.66 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -178.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.413 ' HB2' ' CZ ' ' A' ' 111' ' ' TYR . 39.4 t -57.18 -19.69 22.16 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.462 HG23 ' CG2' ' A' ' 41' ' ' VAL . 0.2 OUTLIER -101.58 -22.45 14.48 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.346 -179.614 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 39.8 mm -47.87 95.19 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.047 0.451 . . . . 0.0 110.999 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -66.73 -26.77 67.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.625 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.733 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 19.1 mttm -148.14 152.6 37.57 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.149 0.5 . . . . 0.0 111.942 -179.227 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -133.95 128.53 34.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.613 179.178 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -133.58 152.83 51.97 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.067 0.46 . . . . 0.0 111.437 -179.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -148.08 153.19 38.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.729 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.414 HG23 ' CE2' ' B' ' 54' ' ' PHE . 37.4 p -75.8 118.82 73.88 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.548 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -64.1 159.11 44.4 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.491 2.127 . . . . 0.0 112.565 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.93 -41.52 98.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.087 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.7 t -57.92 -27.48 63.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.845 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.9 t -85.97 117.91 25.12 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.83 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -57.15 -18.28 14.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.532 179.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.42 ' HD2' ' CE3' ' B' ' 53' ' ' TRP . 21.0 mmtm -74.94 140.54 43.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.935 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 10.7 mmm -120.44 115.47 23.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.444 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.423 ' HE2' ' CE3' ' B' ' 53' ' ' TRP . 0.0 OUTLIER -178.64 169.13 1.72 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.112 0.482 . . . . 0.0 111.839 -179.852 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.404 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -145.73 134.07 21.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.982 179.519 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.405 ' HD2' ' CE1' ' B' ' 54' ' ' PHE . 15.2 mtt180 -125.45 133.1 52.57 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.072 0.463 . . . . 0.0 112.138 -179.136 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.424 ' N ' ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -112.97 131.23 55.84 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.128 179.292 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.733 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.2 mm -99.75 149.99 5.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.77 0.319 . . . . 0.0 111.069 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -120.53 137.74 12.33 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.37 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 24.0 mttp -53.7 141.92 24.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.871 0.367 . . . . 0.0 111.118 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.477 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.4 p -119.57 -161.52 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.799 179.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.477 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 23.8 t0 -165.76 58.94 0.11 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.399 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -57.78 -22.41 46.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.253 -179.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 40.8 m -61.24 -16.62 47.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.959 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.4 mtmt -74.45 -35.83 63.34 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.087 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.1 mttt 61.96 93.63 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.684 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 25.8 mmt85 -95.79 141.41 29.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.103 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 43.8 mmtt -89.9 145.64 24.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.956 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -93.07 172.21 8.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.839 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -60.32 -19.97 57.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.185 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -86.29 4.29 39.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.405 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.92 15.25 81.43 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.676 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -111.39 144.68 40.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.923 0.392 . . . . 0.0 110.967 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -70.73 148.99 47.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.038 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.433 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.4 m -134.17 158.94 42.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.03 179.815 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 33.6 t -100.23 98.99 8.54 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.103 -0.498 . . . . 0.0 109.781 178.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.433 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 85.3 Cg_exo -40.07 148.14 0.18 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.721 2.281 . . . . 0.0 113.034 -179.02 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.502 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -115.72 107.35 48.68 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.012 -179.938 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.502 ' HD2' ' HA ' ' A' ' 83' ' ' LYS . 1.8 Cg_endo -39.09 141.88 0.37 Allowed 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 123.543 2.829 . . . . 0.0 112.585 179.371 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 59.7 mm-40 -65.48 126.34 27.97 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.773 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -122.48 120.42 33.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.931 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.419 ' HB3' ' CE2' ' A' ' 89' ' ' PHE . 94.0 m-70 -98.57 139.23 34.6 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.578 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -121.53 107.86 12.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.256 -179.644 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.493 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 95.5 m-85 -114.94 125.43 53.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.462 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.02 136.15 35.69 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.019 0.437 . . . . 0.0 111.136 -179.57 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.433 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 92.5 m-85 -123.69 158.69 31.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.844 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 68.8 m-20 -115.56 -19.81 10.44 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.405 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -107.33 114.64 28.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.797 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 9.8 mtt85 -57.83 -29.22 64.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.07 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -77.02 -55.15 5.71 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.361 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.6 t -56.85 -45.29 83.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.934 0.397 . . . . 0.0 110.675 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.9 ppp? -63.84 -36.81 85.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.053 179.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -62.52 -33.3 74.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.446 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -67.18 -33.73 76.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.987 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.457 HD13 HG23 ' A' ' 16' ' ' ILE . 17.5 mm -69.83 -48.71 62.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.642 179.346 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.402 ' HA ' ' CD1' ' A' ' 48' ' ' LEU . 8.5 ptpt -64.4 -27.72 69.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.849 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.7 -41.2 31.7 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.447 179.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.448 HG21 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -77.21 -30.85 54.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.691 179.876 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.419 ' O ' HG13 ' A' ' 108' ' ' ILE . 13.5 mt -71.07 -38.63 72.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.788 179.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.445 ' CB ' ' CD2' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -68.4 -29.24 67.88 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.568 179.792 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -71.28 -33.59 69.89 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.709 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.41 ' CD1' ' CD1' ' A' ' 42' ' ' LEU . 16.3 mt -70.2 -47.96 64.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.016 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.459 ' H ' HG13 ' A' ' 108' ' ' ILE . 2.7 mt -57.79 -61.07 1.46 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.631 0 CA-C-O 121.862 0.839 . . . . 0.0 109.224 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 27.3 m -50.2 -28.81 8.15 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.376 179.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -65.11 -35.31 80.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.785 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.413 ' CZ ' ' HB2' ' A' ' 43' ' ' SER . 69.1 m-85 -89.53 -31.09 17.79 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.04 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.48 -34.11 77.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.586 179.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 49.1 t0 -59.11 -37.61 77.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.949 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.97 -33.65 75.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.112 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.964 179.974 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 27.7 tp . . . . . 0 N--CA 1.488 1.429 0 CA-C-O 120.747 0.308 . . . . 0.0 111.154 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 2.1 m -128.28 165.83 28.29 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.875 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_exo -51.91 -44.11 47.37 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.568 2.179 . . . . 0.0 112.316 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -58.25 -29.17 65.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.839 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -63.21 -44.09 96.3 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.766 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 35.4 mm -67.29 -25.35 33.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.244 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -64.26 -32.91 74.68 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.882 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.18 -29.25 67.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.2 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 53' ' ' TRP . . . . . 0.423 ' CE3' ' HE2' ' A' ' 59' ' ' MET . 12.6 m95 -53.56 -29.69 38.32 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.965 0.412 . . . . 0.0 110.894 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 54' ' ' PHE . . . . . 0.414 ' CE2' HG23 ' A' ' 51' ' ' THR . 96.4 m-85 -94.68 -25.08 16.88 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.99 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -82.24 -55.42 4.55 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.77 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -76.64 148.2 37.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.861 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -122.69 76.97 47.53 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.924 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo . . . . . 0 C--O 1.249 1.037 0 C-N-CA 122.57 2.18 . . . . 0.0 112.34 179.997 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_exo . . . . . 0 N--CA 1.477 0.537 0 CA-C-O 121.137 0.39 . . . . 0.0 111.879 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.6 p -79.07 131.35 36.23 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.854 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 33.3 m80 65.15 32.97 9.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.229 0.537 . . . . 0.0 111.204 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.558 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 72.6 p 177.65 142.72 0.09 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.665 179.158 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -177.88 114.48 0.46 Allowed Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.327 179.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.596 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -44.72 100.12 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.204 0.526 . . . . 0.0 111.327 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.496 ' CB ' ' CE2' ' A' ' 91' ' ' PHE . . . -115.71 152.03 33.98 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.066 -178.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.55 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -97.7 124.04 50.45 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.193 178.922 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.504 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 18.7 t80 -112.03 130.31 55.91 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.186 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.42 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 38.9 mt-10 56.07 34.92 24.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.872 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 mtpm? 76.18 0.67 3.31 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.25 -178.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.525 ' O ' HG23 ' A' ' 8' ' ' ILE . 41.3 t -99.92 155.41 4.18 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.713 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.55 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -96.87 149.86 21.39 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 121.379 0.609 . . . . 0.0 112.48 -178.75 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.453 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 174.83 -179.76 45.93 Favored Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.511 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.596 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.96 141.11 22.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 117.68 0.74 . . . . 0.0 110.457 179.307 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.558 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -106.71 118.31 54.2 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 CA-C-N 115.312 -0.858 . . . . 0.0 108.685 179.737 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.418 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -119.75 138.57 53.24 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.201 -178.605 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.432 ' CD1' HG22 ' A' ' 103' ' ' THR . 96.4 mt -112.78 140.08 34.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.327 -178.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -127.08 114.01 17.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.903 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -86.86 5.85 34.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.279 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -79.36 -17.54 54.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.868 0.366 . . . . 0.0 110.426 179.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.02 152.0 5.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.984 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.2 t -129.73 114.74 17.94 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.883 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.82 147.25 89.05 Favored 'Cis proline' 0 C--N 1.349 0.578 0 C-N-CA 123.296 -1.543 . . . . 0.0 111.955 0.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -45.44 136.85 5.27 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.557 179.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -116.95 152.94 33.51 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.376 0.608 . . . . 0.0 112.03 -178.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.424 ' HB2' HD11 ' A' ' 42' ' ' LEU . 2.9 tt -121.3 130.6 53.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.147 179.166 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.9 m -120.52 127.33 52.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.159 0.504 . . . . 0.0 112.049 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.504 ' CH2' ' HB3' ' A' ' 9' ' ' PHE . 60.6 t90 -100.56 126.77 47.04 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.706 179.044 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 38.1 ttt180 -121.35 116.56 25.04 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.854 0.359 . . . . 0.0 110.875 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.407 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 0.9 OUTLIER -45.48 166.92 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.083 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.87 -42.04 61.34 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 121.541 0.686 . . . . 0.0 109.702 179.657 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -82.69 -20.68 35.65 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.837 -1.074 . . . . 0.0 111.121 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.47 34.4 12.05 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.292 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -103.9 -19.71 14.15 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 -179.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.06 144.04 47.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.892 0.377 . . . . 0.0 111.372 -179.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 47.5 t -139.52 140.04 37.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.037 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.498 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 80.8 t60 -134.33 146.22 49.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.052 179.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.423 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 46.4 m -129.15 135.91 49.49 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.337 -179.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 84.7 t -139.24 140.54 37.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 CA-C-O 121.066 0.46 . . . . 0.0 111.645 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.477 ' CG1' HG22 ' A' ' 44' ' ' THR . 1.9 p -88.31 117.6 32.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 177.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.54 ' HA ' HG12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -74.28 -35.91 63.76 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -178.277 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.42 ' OG ' ' CE2' ' A' ' 111' ' ' TYR . 8.3 m -50.04 -25.94 3.88 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -178.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.477 HG22 ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -87.17 -23.52 24.78 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.167 -179.668 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.54 HG12 ' HA ' ' A' ' 42' ' ' LEU . 44.3 mm -50.05 96.66 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.129 0.49 . . . . 0.0 110.917 -179.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.423 ' N ' ' O ' ' A' ' 63' ' ' ILE . 16.7 t0 -72.44 -22.93 61.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.954 -179.232 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.43 ' HB2' HG13 ' A' ' 63' ' ' ILE . 43.4 mttm -157.27 137.91 13.12 Favored 'General case' 0 CA--C 1.522 -0.133 0 C-N-CA 120.422 -0.511 . . . . 0.0 111.949 -179.449 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 15.3 mt -106.34 124.04 48.99 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.903 178.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 91.9 mm-40 -115.51 133.26 56.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.801 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -142.99 146.34 33.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.057 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 74.9 p -75.63 130.56 78.94 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.687 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -67.02 160.21 48.35 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.49 2.127 . . . . 0.0 112.519 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.07 -42.87 95.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.02 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 87.1 p -60.63 -26.47 67.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.773 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.6 m -77.36 120.16 21.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.861 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -56.98 -18.1 12.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.409 179.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -67.28 155.96 37.57 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.956 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 44.0 mtp -142.96 80.5 1.69 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.725 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.443 ' CE ' ' CE2' ' B' ' 54' ' ' PHE . 10.4 tmm? -162.35 149.37 13.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.453 -179.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.35 152.98 32.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.479 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.428 ' HB2' ' CE2' ' B' ' 54' ' ' PHE . 56.2 ttt180 -137.91 135.41 36.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.995 0.426 . . . . 0.0 111.886 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.462 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -103.53 144.24 31.68 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.384 179.501 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.43 HG13 ' HB2' ' A' ' 47' ' ' LYS . 1.2 mm -116.47 122.65 70.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.059 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.63 151.92 20.56 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.415 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.8 mttt -70.47 136.41 49.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.845 0.355 . . . . 0.0 111.001 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.488 ' CG2' ' N ' ' A' ' 67' ' ' ASP . 1.4 p -70.15 160.51 5.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.299 0.571 . . . . 0.0 111.312 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.488 ' N ' ' CG2' ' A' ' 66' ' ' VAL . 0.5 OUTLIER -113.18 130.69 56.13 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.784 179.901 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -95.0 3.63 54.71 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.453 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 24.0 t -72.08 -9.99 59.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.326 -179.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.71 -69.1 0.77 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.757 0.313 . . . . 0.0 111.176 -179.758 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.6 mmtt 62.47 94.23 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.788 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 16.6 mtt-85 -108.17 153.13 23.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.037 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.5 mmtp -93.28 147.73 22.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.986 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -90.47 176.71 6.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.005 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -63.75 -18.67 64.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.272 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -88.57 -5.89 57.9 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.344 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 91.88 9.52 62.4 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.711 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 -105.95 145.15 31.67 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.892 0.377 . . . . 0.0 110.965 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -72.3 144.08 48.48 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.915 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.412 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.3 m -132.3 158.82 43.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.175 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 32.5 t -101.5 98.8 9.95 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.678 178.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.412 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 99.2 Cg_exo -42.0 158.54 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.597 2.198 . . . . 0.0 112.743 -179.113 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.426 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.1 OUTLIER -69.86 149.96 96.51 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-O 121.115 0.483 . . . . 0.0 111.055 -179.874 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 16.8 Cg_exo -72.34 164.14 36.52 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 123.473 2.782 . . . . 0.0 112.622 -179.073 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 -65.55 157.36 29.93 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.692 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 62.3 mtm180 -150.11 119.82 7.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.799 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.421 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 36.2 m-70 -105.32 159.06 16.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.465 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -126.67 144.6 50.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.213 0.53 . . . . 0.0 111.681 -179.503 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.491 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 97.7 m-85 -157.51 125.21 5.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.119 179.406 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 22.6 t -109.36 139.86 43.79 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.899 0.381 . . . . 0.0 111.387 -179.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.513 ' CD1' ' N ' ' A' ' 91' ' ' PHE . 0.8 OUTLIER -126.76 146.57 50.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.521 179.681 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -87.21 -18.04 31.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.312 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -109.43 119.43 39.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.819 0.343 . . . . 0.0 110.741 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.62 -31.83 66.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.986 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.91 -46.73 73.92 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.168 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 48.3 t -59.86 -34.2 55.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.484 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.466 ' HG2' ' CG ' ' A' ' 91' ' ' PHE . 0.2 OUTLIER -63.59 -37.55 87.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.523 179.568 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -71.06 -36.61 72.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.86 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -60.22 -47.39 86.16 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.762 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.416 ' CD1' HG21 ' A' ' 16' ' ' ILE . 24.5 mm -65.46 -48.98 80.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.888 179.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.23 -27.61 68.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.898 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 44.6 mtm -78.65 -37.79 41.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.466 179.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.432 HG22 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -79.43 -38.97 33.49 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.744 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 30.2 mt -64.7 -39.62 93.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.591 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -61.92 -31.09 71.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.519 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -68.52 -35.45 77.49 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.666 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 58.2 mt -68.22 -48.49 73.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.957 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.442 ' H ' HG13 ' A' ' 108' ' ' ILE . 2.7 mt -59.93 -61.07 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.508 -0.668 0 CA-C-O 121.663 0.744 . . . . 0.0 109.06 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.5 m -49.74 -28.94 6.81 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.248 -1.342 . . . . 0.0 110.81 179.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 31.3 mtt-85 -66.97 -34.8 78.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.707 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.42 ' CE2' ' OG ' ' A' ' 43' ' ' SER . 86.6 m-85 -96.41 -30.62 13.27 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.888 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.413 ' CD ' ' CG2' ' A' ' 108' ' ' ILE . 0.0 OUTLIER -68.68 -37.53 79.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.626 179.693 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -61.12 -37.3 82.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.887 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.02 -33.95 76.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.13 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 86.9 m-20 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.272 -0.87 . . . . 0.0 110.937 179.962 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 52.0 mt . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.855 0.36 . . . . 0.0 111.199 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 16.2 p -117.42 159.49 41.57 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.9 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -52.82 -39.33 77.93 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.603 2.202 . . . . 0.0 112.319 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -56.33 -26.46 52.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.962 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -63.07 -41.72 99.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.779 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.405 HD11 HG22 ' B' ' 50' ' ' ILE . 36.9 mm -68.77 -27.02 34.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.242 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -66.27 -34.45 78.02 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.921 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.87 -31.44 72.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.858 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 53' ' ' TRP . . . . . . . . . . . . . 12.3 m95 -58.5 -34.73 71.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.98 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 54' ' ' PHE . . . . . 0.443 ' CE2' ' CE ' ' A' ' 59' ' ' MET . 89.5 m-85 -101.82 -13.77 17.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.215 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -89.09 -25.99 21.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.967 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -56.04 145.83 24.44 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.08 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -105.08 155.34 37.84 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.872 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo . . . . . 0 C--O 1.25 1.111 0 C-N-CA 122.538 2.159 . . . . 0.0 112.307 179.974 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo . . . . . 0 N--CA 1.476 0.451 0 CA-C-O 120.887 0.286 . . . . 0.0 111.781 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.0 m -158.33 -50.18 0.06 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.847 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -137.9 34.02 2.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.174 0.511 . . . . 0.0 110.828 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.514 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 49.9 p 179.97 120.43 0.06 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.709 179.103 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.417 ' O ' ' C ' ' A' ' 6' ' ' ALA . . . -147.4 115.75 0.79 Allowed Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.781 -0.723 . . . . 0.0 111.963 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.529 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -34.2 118.68 0.39 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.794 0.33 . . . . 0.0 111.116 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.442 ' O ' ' O ' ' A' ' 14' ' ' GLY . . . -133.46 150.98 51.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.075 -178.734 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.58 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.4 mp -99.83 124.57 53.31 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 CA-C-O 121.157 0.503 . . . . 0.0 110.521 179.227 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.492 ' CD1' ' CE1' ' A' ' 89' ' ' PHE . 18.2 t80 -116.62 132.53 56.66 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.033 179.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.418 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 89.7 mt-10 57.41 33.48 23.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.741 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.5 mttm 75.29 1.24 3.65 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.001 -178.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.481 ' O ' ' N ' ' A' ' 9' ' ' PHE . 25.0 t -101.0 144.37 12.94 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.769 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.752 179.078 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.58 ' HA ' HG13 ' A' ' 8' ' ' ILE . 81.0 p -83.72 145.6 28.65 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.278 -179.568 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.442 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . -174.3 -179.12 44.71 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.844 -179.377 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.529 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 4.5 mm -105.37 135.27 44.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-O 120.914 0.388 . . . . 0.0 110.373 179.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.514 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.2 OUTLIER -106.44 118.01 53.3 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.884 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 178.634 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.436 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -122.08 128.69 51.63 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.345 0.593 . . . . 0.0 111.84 -177.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.421 ' CD1' HG21 ' A' ' 103' ' ' THR . 59.8 mt -101.77 140.01 21.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.787 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.406 ' ND2' ' CG2' ' A' ' 22' ' ' VAL . 50.2 p-10 -131.27 111.47 11.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.999 0.428 . . . . 0.0 111.168 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -92.4 4.01 54.29 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.419 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -78.35 -17.71 56.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.962 0.41 . . . . 0.0 110.414 179.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.406 ' CG2' ' ND2' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -100.88 151.32 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.015 -179.719 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.1 t -123.67 117.56 27.53 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.642 179.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.408 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 1.6 Cg_endo -79.74 145.65 73.81 Favored 'Cis proline' 0 C--N 1.348 0.517 0 C-N-CA 123.678 -1.384 . . . . 0.0 112.044 0.008 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.21 145.86 2.11 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.714 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -137.41 167.05 22.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.307 0.575 . . . . 0.0 111.983 -179.126 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.4 tt -125.86 124.67 41.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.388 179.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.5 m -116.69 130.53 56.79 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.147 0.499 . . . . 0.0 112.056 -178.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.489 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 58.7 t90 -100.63 129.01 46.49 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.241 179.096 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 45.4 ttt-85 -127.75 116.99 21.07 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.504 179.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.5 m -44.66 155.96 0.09 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.952 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.407 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -65.4 -39.35 92.07 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.638 0.732 . . . . 0.0 109.25 179.978 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -85.03 -23.1 28.76 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 114.68 -1.146 . . . . 0.0 111.129 179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.85 32.06 10.43 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.601 179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -94.71 -21.86 18.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.592 0.234 . . . . 0.0 111.48 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.47 147.02 44.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.902 0.382 . . . . 0.0 111.17 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 14.7 p -139.13 138.14 41.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.126 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.487 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 32.7 t60 -136.44 145.87 45.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.984 0.421 . . . . 0.0 111.173 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 40.3 m -129.2 137.25 51.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.998 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 88.2 t -134.1 140.85 45.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 121.186 0.517 . . . . 0.0 111.754 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.474 ' CG1' HG22 ' A' ' 44' ' ' THR . 1.7 p -87.95 117.77 32.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 178.024 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.405 ' HA ' HG12 ' A' ' 45' ' ' ILE . 58.2 mt -75.21 -29.66 60.39 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -178.607 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.414 ' HB2' ' CZ ' ' A' ' 111' ' ' TYR . 8.1 t -55.86 -22.16 23.76 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.109 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.474 HG22 ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -94.8 -21.63 18.59 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.137 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.405 HG12 ' HA ' ' A' ' 42' ' ' LEU . 39.3 mm -57.95 88.26 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.983 0.421 . . . . 0.0 110.922 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -70.04 -29.06 66.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.383 -179.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.647 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 18.2 mttm -138.99 142.36 38.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.969 0.414 . . . . 0.0 111.575 -179.294 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -124.71 124.41 42.11 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.609 179.134 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -116.82 139.32 50.74 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.049 -179.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.39 144.22 31.96 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.969 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 32.3 p -75.65 113.44 26.67 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.548 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.46 160.57 35.02 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.545 2.164 . . . . 0.0 112.643 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.01 -42.97 77.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.243 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.5 m -58.29 -27.63 64.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.725 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 23.4 t -85.06 118.2 24.49 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.891 179.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -56.22 -18.7 11.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.583 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.435 ' HD2' ' CE3' ' B' ' 53' ' ' TRP . 39.6 mmtm -65.44 159.03 25.18 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.871 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.444 ' HE3' ' HA ' ' A' ' 92' ' ' ASN . 26.8 mtp -142.92 79.92 1.67 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.819 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.455 ' CE ' ' CE3' ' B' ' 53' ' ' TRP . 29.3 mtm -154.7 169.09 24.72 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.152 0.501 . . . . 0.0 111.633 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.434 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -140.79 123.88 16.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.529 -0.759 . . . . 0.0 109.955 179.502 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 47.1 ttt180 -113.43 137.11 52.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.853 0.358 . . . . 0.0 111.789 -179.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.442 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -112.61 144.08 42.71 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.624 179.749 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.647 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 2.0 mm -114.79 124.32 71.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.025 179.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -90.37 129.93 9.99 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.466 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 48.3 mttt -45.9 152.43 0.37 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.738 0.304 . . . . 0.0 111.284 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.438 ' CG1' ' N ' ' A' ' 67' ' ' ASP . 1.0 OUTLIER -122.23 -162.89 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.865 -179.944 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.438 ' N ' ' CG1' ' A' ' 66' ' ' VAL . 9.7 t0 179.67 51.52 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.402 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -57.5 -22.3 43.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.402 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.9 m -63.89 -14.26 52.01 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.135 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.2 mtmt -70.14 -45.47 66.75 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.846 0.355 . . . . 0.0 111.307 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.1 mttm 61.42 93.31 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.672 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.83 151.44 25.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.001 -179.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.6 mmtm -86.16 145.44 27.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.076 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 43.7 p30 -95.77 177.45 5.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.896 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -60.28 -19.98 57.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.337 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -88.45 9.75 22.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.513 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 70.31 17.86 74.6 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.696 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -115.52 145.87 42.23 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.862 0.363 . . . . 0.0 110.754 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 55.7 mp0 -74.56 142.5 44.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.97 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.452 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.0 m -131.36 158.88 43.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.01 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.4 t -102.29 98.52 10.67 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.712 178.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.452 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 87.2 Cg_exo -45.83 163.49 0.09 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.493 2.129 . . . . 0.0 112.578 -179.089 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.451 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 21.5 mtpp -117.99 147.74 41.96 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.97 0.414 . . . . 0.0 110.991 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 16.5 Cg_exo -72.7 136.27 25.29 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 123.363 2.708 . . . . 0.0 112.665 -179.045 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 40.0 mm-40 -67.01 149.32 50.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.72 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.2 mtp85 -151.59 120.0 6.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.747 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -104.59 144.94 31.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.769 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.4 ttt -122.94 118.34 27.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.887 0.375 . . . . 0.0 111.224 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.492 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 93.7 m-85 -124.98 141.94 51.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.521 179.713 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 1.3 p -114.0 135.67 53.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.899 0.38 . . . . 0.0 111.054 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.434 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 23.8 m-85 -122.47 156.48 34.01 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.75 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.444 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 57.6 m-20 -118.78 20.3 12.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.111 179.713 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -147.9 110.2 4.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.844 0.354 . . . . 0.0 110.669 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 15.5 mtt-85 -54.46 -29.33 49.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.066 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -75.79 -55.04 6.01 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.356 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 46.6 t -56.08 -47.41 80.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.622 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.5 ppp? -63.06 -35.55 80.62 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.84 179.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -61.12 -35.19 76.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.397 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -67.9 -35.38 78.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.197 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.504 HD13 HG21 ' A' ' 16' ' ' ILE . 18.3 mm -70.73 -52.07 31.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.719 179.41 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.58 -28.04 69.06 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.862 179.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 46.3 mtm -78.46 -40.81 34.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.655 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.421 HG21 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -78.15 -31.84 49.96 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.624 179.916 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 14.0 mt -65.94 -39.89 90.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.887 0.375 . . . . 0.0 110.661 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -63.1 -28.43 70.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.037 179.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -70.25 -36.85 74.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.052 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 6.0 mt -69.47 -46.98 74.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.356 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.445 ' H ' HG13 ' A' ' 108' ' ' ILE . 2.3 mt -57.22 -61.11 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.597 0 CA-C-O 121.696 0.76 . . . . 0.0 109.584 179.278 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 29.9 m -51.51 -28.68 14.21 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.458 179.049 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 4.3 mtt-85 -66.27 -35.35 80.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.787 179.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.414 ' CZ ' ' HB2' ' A' ' 43' ' ' SER . 79.8 m-85 -93.13 -34.48 13.62 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.954 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.35 -37.09 85.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.982 0.42 . . . . 0.0 110.748 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -60.95 -38.68 86.73 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.0 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.04 -35.13 80.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.133 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 51.8 t0 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.218 -0.896 . . . . 0.0 111.002 179.873 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 7.3 tt . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.853 0.358 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 15.2 p -123.62 164.7 27.0 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.833 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_exo -51.83 -43.42 51.73 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.554 2.169 . . . . 0.0 112.35 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -59.02 -28.82 66.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.996 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -73.26 -49.1 29.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.164 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 34.4 mm -56.42 -31.66 33.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.528 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 19.0 pt-20 -80.48 -26.05 38.46 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.921 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.56 -30.72 70.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.637 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 53' ' ' TRP . . . . . 0.455 ' CE3' ' CE ' ' A' ' 59' ' ' MET . 13.0 m0 -58.05 -36.06 72.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.998 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 54' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -93.87 -0.77 55.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.434 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -76.39 -30.8 57.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.756 0.312 . . . . 0.0 110.812 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -59.7 138.31 57.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.903 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -167.56 75.13 0.97 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.923 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo . . . . . 0 C--O 1.249 1.042 0 C-N-CA 122.532 2.155 . . . . 0.0 112.234 -179.914 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . 0.401 ' CB ' ' ND2' ' A' ' 99' ' ' ASN . 12.0 Cg_endo . . . . . 0 N--CA 1.477 0.551 0 CA-C-O 120.873 0.281 . . . . 0.0 111.797 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.8 m -148.03 123.68 10.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.024 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.448 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 52.3 m80 64.53 29.05 13.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.207 0.527 . . . . 0.0 111.367 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.501 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 0.9 OUTLIER -172.69 139.97 0.96 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.549 179.022 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.402 ' CA ' ' CG1' ' A' ' 96' ' ' VAL . . . -171.49 118.27 0.73 Allowed Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.319 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.598 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -47.84 100.2 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.18 0.514 . . . . 0.0 111.212 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.453 ' CB ' ' CE2' ' A' ' 91' ' ' PHE . . . -114.63 152.19 32.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.914 -178.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.537 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -100.57 123.72 53.68 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.259 0 CA-C-O 120.956 0.408 . . . . 0.0 110.414 178.998 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.5 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 14.4 t80 -111.3 131.16 55.37 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.173 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.424 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 37.1 mt-10 54.85 34.94 23.15 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.936 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.5 mttm 75.84 1.78 3.58 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.35 -179.178 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.53 ' O ' HG21 ' A' ' 8' ' ' ILE . 40.9 t -100.04 154.6 4.33 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.69 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 178.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.537 ' HA ' HG13 ' A' ' 8' ' ' ILE . 94.4 p -97.01 149.62 21.71 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.674 0.75 . . . . 0.0 112.776 -178.629 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.436 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 174.38 -179.84 45.46 Favored Glycine 0 N--CA 1.447 -0.623 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.241 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.598 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -107.15 141.93 21.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 117.801 0.801 . . . . 0.0 110.583 179.407 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.501 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.2 OUTLIER -106.73 118.43 54.44 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 CA-C-N 115.283 -0.871 . . . . 0.0 108.653 179.527 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.445 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -120.53 131.2 54.58 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.223 0.535 . . . . 0.0 111.213 -178.717 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.448 ' O ' ' HB3' ' A' ' 3' ' ' HIS . 76.9 mt -103.25 140.22 22.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.207 -179.08 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -131.54 111.46 11.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.882 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -90.61 6.35 44.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.214 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -79.28 -17.88 53.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.9 0.381 . . . . 0.0 110.448 179.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -100.25 143.04 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.095 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.0 t -115.33 116.47 41.79 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.722 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.419 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 1.5 Cg_endo -80.8 143.24 61.68 Favored 'Cis proline' 0 C--N 1.348 0.525 0 C-N-CA 123.816 -1.327 . . . . 0.0 111.956 -0.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.26 142.42 2.91 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.053 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -135.61 167.3 21.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.191 0.519 . . . . 0.0 111.57 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.8 tt -121.04 130.94 53.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.806 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 48.0 m -117.74 126.01 51.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.199 0.524 . . . . 0.0 112.074 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.489 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 56.9 t90 -100.58 129.09 46.47 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.075 179.07 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 26.2 ttt85 -123.94 117.57 25.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.91 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.9 t -45.51 166.53 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.102 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.77 -42.64 57.81 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-O 121.452 0.644 . . . . 0.0 109.62 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -86.46 -16.62 36.54 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.079 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.8 34.24 13.82 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.238 -179.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -97.75 -21.62 16.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.573 0.225 . . . . 0.0 111.6 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.99 146.76 41.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.027 0.442 . . . . 0.0 111.597 -179.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 47.5 t -139.56 140.49 36.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.769 179.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.5 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 38.1 t60 -135.55 145.58 47.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.023 0.44 . . . . 0.0 111.321 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 47.7 m -129.32 135.27 48.52 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.86 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.4 t -130.84 140.89 47.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 121.142 0.496 . . . . 0.0 111.612 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.465 ' CG1' HG23 ' A' ' 44' ' ' THR . 2.0 p -86.41 117.78 31.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 178.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.433 ' HA ' HG12 ' A' ' 45' ' ' ILE . 66.3 mt -75.39 -30.68 60.21 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.259 -0.428 . . . . 0.0 112.092 -178.618 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.419 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 11.4 t -55.64 -21.88 20.03 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 -178.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.465 HG23 ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -94.41 -21.57 18.86 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.718 0.294 . . . . 0.0 111.36 -179.673 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.433 HG12 ' HA ' ' A' ' 42' ' ' LEU . 37.3 mm -51.76 92.71 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.97 0.414 . . . . 0.0 111.091 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -66.07 -29.73 70.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.109 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.627 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 18.2 mttp -153.35 158.99 42.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.977 0.418 . . . . 0.0 111.302 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.43 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -131.66 128.82 39.86 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.948 179.381 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -119.92 144.97 47.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.93 0.395 . . . . 0.0 111.072 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -148.06 141.63 25.47 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.033 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 73.3 p -75.69 117.17 61.6 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.587 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -62.05 160.56 29.57 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.519 2.146 . . . . 0.0 112.564 -179.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.67 -43.11 80.08 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.095 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 84.3 p -62.32 -27.48 69.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.053 0.454 . . . . 0.0 110.558 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.4 m -79.72 120.52 24.13 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.844 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.4 tp10 -55.62 -19.02 8.98 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.453 179.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.449 ' CG ' ' CE3' ' B' ' 53' ' ' TRP . 0.0 OUTLIER -71.51 141.13 50.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.9 179.859 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.459 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 63.5 mtp -131.25 79.81 1.9 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.542 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.414 ' HE3' ' CE3' ' B' ' 53' ' ' TRP . 38.3 mtm -155.79 169.09 25.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.163 0.506 . . . . 0.0 111.527 -179.449 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.7 tp -134.17 124.03 25.34 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.113 179.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.42 ' HB2' ' CZ ' ' B' ' 54' ' ' PHE . 53.2 ttt180 -112.27 126.53 55.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.938 0.399 . . . . 0.0 111.783 -179.369 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.437 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -105.47 143.7 33.27 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.38 179.423 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.627 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.5 mm -108.78 121.98 62.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.744 0.307 . . . . 0.0 111.174 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -90.5 128.09 9.11 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.206 179.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 23.6 mttt -50.04 146.09 5.14 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.879 0.371 . . . . 0.0 111.164 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.444 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.4 p -111.14 -162.15 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.051 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.444 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 7.2 m-20 -173.03 71.62 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.245 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -55.73 -22.28 22.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.437 -179.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 26.8 t -59.35 -17.48 30.11 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.085 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 62.3 mmtt -64.8 -45.28 86.91 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.794 0.33 . . . . 0.0 111.025 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.3 mptt 61.63 94.08 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.747 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 26.2 mmt180 -90.74 165.77 13.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.888 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.8 mttp -125.54 147.4 49.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.129 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -78.35 172.43 13.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.746 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -57.67 -24.0 54.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.227 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 48.8 mp0 -95.1 19.59 10.27 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.28 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.52 9.23 84.62 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.901 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -67.3 -163.5 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.696 0.284 . . . . 0.0 110.799 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -137.95 138.19 38.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.715 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.456 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 1.8 m -140.62 156.32 23.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.221 0.534 . . . . 0.0 111.376 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.437 HG11 ' O ' ' A' ' 81' ' ' VAL . 3.0 p -99.12 98.96 7.16 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 114.993 -1.003 . . . . 0.0 109.916 179.257 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.456 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 96.8 Cg_exo -41.9 145.32 0.77 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.663 2.242 . . . . 0.0 112.853 -178.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.435 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 3.4 mmpt? -94.45 153.12 40.44 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.995 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 19.0 Cg_exo -71.55 141.65 38.67 Favored 'Trans proline' 0 N--CA 1.466 -0.133 0 C-N-CA 123.406 2.737 . . . . 0.0 112.7 -179.01 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -65.55 147.26 53.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.859 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.63 119.8 7.26 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.668 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -100.62 156.93 17.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.709 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.8 ttt -133.53 126.82 31.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.237 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.442 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 90.2 m-85 -134.22 148.19 50.82 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.518 179.625 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 38.7 t -128.56 133.1 48.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.952 0.406 . . . . 0.0 111.356 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.512 ' CD1' ' N ' ' A' ' 91' ' ' PHE . 0.7 OUTLIER -123.38 160.99 25.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.286 179.679 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.459 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 36.1 m-20 -114.3 28.36 8.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.846 0.355 . . . . 0.0 110.876 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -152.7 110.12 3.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.608 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.84 -31.17 37.68 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.016 0.436 . . . . 0.0 110.892 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.61 -54.87 11.91 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.944 179.808 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.402 ' CG1' ' CA ' ' A' ' 5' ' ' GLY . 50.8 t -58.76 -35.73 57.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.06 0.457 . . . . 0.0 110.332 179.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.46 ' HG3' ' CD1' ' A' ' 91' ' ' PHE . 1.7 ttp -66.74 -38.56 86.89 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.641 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.487 ' O ' ' HB3' ' A' ' 102' ' ' MET . 52.0 t0 -69.36 -35.32 75.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.769 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.401 ' ND2' ' CB ' ' A' ' 1' ' ' PRO . 76.9 m-20 -61.57 -35.64 78.39 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.154 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.469 HD11 ' CG2' ' A' ' 16' ' ' ILE . 18.1 mm -71.69 -50.86 36.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.791 179.63 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 98' ' ' ASP . 1.0 OUTLIER -63.24 -27.37 69.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.798 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.487 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.7 OUTLIER -78.51 -41.74 31.52 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.201 179.626 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.434 HG22 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -71.92 -40.08 69.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.804 -179.999 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 13.6 mt -61.62 -38.8 88.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.764 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -63.42 -27.07 69.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.96 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -70.08 -34.07 72.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.124 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 3.8 mt -74.22 -45.83 46.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.561 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.414 ' CG2' ' CD ' ' A' ' 112' ' ' LYS . 2.3 mt -56.64 -61.25 1.28 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.542 0 CA-C-O 121.734 0.778 . . . . 0.0 109.5 179.388 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.1 t -49.45 -28.87 5.74 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.783 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 7.2 mtt-85 -67.5 -35.33 78.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.625 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -93.41 -31.88 14.45 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.729 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.414 ' CD ' ' CG2' ' A' ' 108' ' ' ILE . 0.0 OUTLIER -65.54 -36.69 84.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.523 179.676 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -60.61 -36.91 79.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.924 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.26 -33.41 74.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.087 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 23.0 t70 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.92 179.972 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 63.8 mt . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 120.826 0.346 . . . . 0.0 111.107 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.4 m -131.39 166.81 25.2 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.952 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_exo -51.72 -35.79 59.37 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.598 2.199 . . . . 0.0 112.369 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -54.63 -25.89 29.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.876 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -63.17 -45.34 92.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.801 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.428 HG22 HD13 ' B' ' 50' ' ' ILE . 38.0 mm -68.72 -22.44 26.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.309 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -63.68 -32.76 74.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.882 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.73 -30.7 67.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.978 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 53' ' ' TRP . . . . . 0.449 ' CE3' ' CG ' ' A' ' 57' ' ' LYS . 15.2 m95 -53.99 -25.29 20.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.946 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 54' ' ' PHE . . . . . 0.42 ' CZ ' ' HB2' ' A' ' 61' ' ' ARG . 96.2 m-85 -106.86 -22.19 12.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.153 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -81.96 -33.69 30.12 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.877 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -59.97 140.28 56.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.973 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -128.73 163.62 43.94 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.908 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo . . . . . 0 C--O 1.249 1.056 0 C-N-CA 122.643 2.228 . . . . 0.0 112.324 179.92 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo . . . . . 0 N--CA 1.477 0.519 0 CA-C-O 120.873 0.28 . . . . 0.0 111.861 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.3 m -95.14 132.3 40.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.86 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.409 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 25.3 m80 64.37 30.52 13.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.173 0.511 . . . . 0.0 110.999 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.556 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 88.4 p 174.91 126.69 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.634 178.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.419 ' O ' ' C ' ' A' ' 6' ' ' ALA . . . -163.6 110.37 0.42 Allowed Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.868 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.551 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -33.11 116.33 0.23 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.812 0.339 . . . . 0.0 111.261 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.45 ' HB2' ' HB ' ' A' ' 16' ' ' ILE . . . -133.63 151.84 51.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.081 -0.508 . . . . 0.0 112.08 -178.744 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.564 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.0 OUTLIER -97.62 125.12 50.85 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.226 0 CA-C-O 121.062 0.458 . . . . 0.0 110.56 179.203 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.508 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 25.2 t80 -116.65 128.52 55.45 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.912 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.422 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 88.7 mt-10 59.31 33.58 22.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.721 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.7 mttt 75.94 1.87 3.56 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.183 -178.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.465 ' O ' HG22 ' A' ' 8' ' ' ILE . 35.2 t -101.13 152.07 5.22 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.755 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 178.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.564 ' HA ' HG13 ' A' ' 8' ' ' ILE . 83.4 p -90.65 146.0 24.39 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 121.377 0.608 . . . . 0.0 111.518 -179.384 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.436 ' O ' ' N ' ' A' ' 7' ' ' ALA . . . -177.07 -179.17 47.31 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.702 -179.565 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.551 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.4 mm -105.21 136.2 40.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 120.859 0.362 . . . . 0.0 110.285 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.556 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -106.58 117.89 53.23 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 178.934 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.455 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -124.17 133.73 53.49 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.359 -178.118 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.456 ' CD1' HG23 ' A' ' 103' ' ' THR . 82.6 mt -105.8 140.0 25.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.353 -179.031 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -131.36 114.81 15.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.841 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -92.83 5.33 51.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.364 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -78.95 -17.97 54.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.035 0.445 . . . . 0.0 110.383 179.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.25 143.48 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.866 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.8 m -117.78 119.66 33.69 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.861 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.418 ' CB ' ' HB3' ' A' ' 43' ' ' SER . 3.4 Cg_exo -78.71 141.1 62.53 Favored 'Cis proline' 0 C--N 1.348 0.548 0 C-N-CA 123.621 -1.408 . . . . 0.0 111.786 -0.151 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -43.59 137.68 2.83 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.01 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -130.24 165.04 23.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.159 0.504 . . . . 0.0 111.835 -179.049 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 7.0 tt -121.12 125.68 47.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.472 179.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.6 m -113.29 128.9 56.62 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.474 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 58.9 t90 -100.56 126.63 47.03 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.931 178.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.46 117.81 25.24 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.653 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 29.7 t -44.42 157.29 0.06 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.882 -179.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.43 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.2 OUTLIER -65.18 -39.11 92.44 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.624 0.726 . . . . 0.0 109.146 179.863 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 -85.24 -23.95 28.0 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.629 -1.169 . . . . 0.0 111.017 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 91.28 31.69 9.47 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.615 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -100.0 -19.94 16.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.696 0.284 . . . . 0.0 111.437 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.62 141.49 49.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.825 0.345 . . . . 0.0 111.092 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 13.5 p -139.13 135.02 41.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.27 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.508 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 70.8 t60 -135.07 146.32 48.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.201 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 40.0 m -126.58 140.52 52.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.077 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 93.3 t -134.68 140.93 44.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 121.118 0.485 . . . . 0.0 111.698 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.458 ' CG1' ' CG2' ' A' ' 44' ' ' THR . 1.5 p -86.02 118.09 31.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.491 ' HA ' HG12 ' A' ' 45' ' ' ILE . 46.3 mt -74.53 -30.15 61.66 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -178.313 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.418 ' HB3' ' CB ' ' A' ' 24' ' ' PRO . 60.2 p -56.14 -22.06 26.27 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -178.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.458 ' CG2' ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -90.82 -24.29 20.34 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.883 0.373 . . . . 0.0 111.331 -179.596 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.491 HG12 ' HA ' ' A' ' 42' ' ' LEU . 42.3 mm -57.78 92.04 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.806 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -80.42 -26.11 38.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.734 -179.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.659 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 19.4 mtmt -137.61 152.83 49.79 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.201 0.524 . . . . 0.0 112.049 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.472 HD12 ' N ' ' A' ' 105' ' ' GLN . 22.2 mt -116.28 124.41 50.11 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.032 179.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.407 ' CB ' ' HG3' ' A' ' 61' ' ' ARG . 10.4 mp0 -121.91 130.31 53.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.893 0.378 . . . . 0.0 110.823 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -144.66 143.92 30.98 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.965 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.408 HG21 ' CE2' ' B' ' 54' ' ' PHE . 72.7 p -75.67 123.74 88.52 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.46 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -61.1 154.54 56.57 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.597 2.198 . . . . 0.0 112.537 -179.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.17 -42.49 98.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.125 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.6 t -58.07 -27.61 63.8 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.05 0.452 . . . . 0.0 110.831 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.6 t -80.21 119.16 22.6 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.808 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -55.95 -18.65 9.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.521 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.429 ' HD2' ' CD2' ' B' ' 53' ' ' TRP . 5.3 mttm -81.4 126.23 31.36 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.94 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.459 ' HE1' ' HA ' ' A' ' 92' ' ' ASN . 28.4 mtp -107.93 117.62 34.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.593 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.424 ' HE1' ' CE3' ' B' ' 53' ' ' TRP . 1.7 ttm -174.59 167.97 3.79 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.185 0.517 . . . . 0.0 111.791 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.412 HD21 ' CE1' ' A' ' 91' ' ' PHE . 1.6 tp -153.58 138.97 17.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.918 179.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.419 ' HG2' ' CZ ' ' B' ' 54' ' ' PHE . 0.2 OUTLIER -139.98 148.09 41.39 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.005 0.431 . . . . 0.0 111.869 -179.649 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.495 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -109.47 144.34 37.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.582 179.919 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.659 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 2.5 mm -105.82 121.72 58.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.766 0.317 . . . . 0.0 111.112 179.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -86.07 131.39 10.48 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.313 179.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.4 mttt -46.34 150.63 0.61 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.702 0.287 . . . . 0.0 111.334 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.445 ' CG1' ' N ' ' A' ' 67' ' ' ASP . 1.3 p -116.86 -162.09 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.973 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.445 ' N ' ' CG1' ' A' ' 66' ' ' VAL . 25.9 m-20 -166.29 59.8 0.1 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.324 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 86.7 mt-10 -57.44 -21.5 37.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.411 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 32.7 t -58.6 -18.23 28.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.116 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -67.56 -51.43 50.77 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.887 0.375 . . . . 0.0 110.956 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.6 mttt 57.65 88.12 0.06 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.033 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.71 135.33 39.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.811 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 18.1 mmtm -75.24 144.84 42.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.313 -179.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -95.23 174.15 7.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.87 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -59.6 -19.88 51.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.324 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 49.3 mp0 -87.66 7.69 28.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.434 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.05 18.59 79.24 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.6 -0.81 . . . . 0.0 112.685 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -115.56 145.51 42.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.746 0.307 . . . . 0.0 111.024 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -76.45 146.32 38.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.897 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.413 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 1.3 m -133.7 158.72 42.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.213 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.2 t -103.55 98.68 13.21 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.724 178.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.413 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 87.4 Cg_exo -46.13 145.52 5.32 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 122.448 2.099 . . . . 0.0 112.438 -179.157 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 2.1 mptt -83.45 143.44 44.53 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.056 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 15.1 Cg_exo -73.55 152.56 48.72 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 123.558 2.839 . . . . 0.0 112.629 -178.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -67.2 147.76 52.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.585 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.8 mtp-105 -147.56 120.05 8.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.156 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -99.06 159.05 15.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.402 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 23.1 ttt -133.41 138.94 46.47 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.006 0.431 . . . . 0.0 111.567 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.495 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 95.3 m-85 -152.02 125.41 8.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.214 179.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.7 t -98.98 133.01 43.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.095 0.474 . . . . 0.0 111.314 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.44 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 80.7 m-85 -120.19 152.71 37.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.629 179.664 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.459 ' HA ' ' HE1' ' A' ' 58' ' ' MET . 16.7 m-20 -108.4 -6.62 16.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.371 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -121.64 108.73 13.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.871 0.367 . . . . 0.0 110.749 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.86 -28.62 3.88 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.112 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -76.28 -54.93 6.06 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.205 -179.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 58.9 t -53.42 -47.88 58.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.772 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.4 -35.68 78.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.222 179.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 54.5 t0 -64.63 -35.63 81.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.465 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 53.9 m-80 -65.45 -42.93 91.8 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.971 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.435 ' CD1' HG22 ' A' ' 16' ' ' ILE . 27.4 mm -62.38 -52.15 63.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.573 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 6.9 pttp -64.05 -27.87 69.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.657 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 38.4 mtm -78.84 -40.41 32.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.741 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.456 HG23 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -75.56 -43.52 48.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.016 -179.825 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.401 ' CD2' ' CD2' ' A' ' 42' ' ' LEU . 3.5 mt -61.43 -33.97 74.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.818 0.342 . . . . 0.0 110.981 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.472 ' N ' HD12 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -67.85 -26.51 66.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.696 -179.988 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -69.49 -30.1 67.89 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.559 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 3.9 mt -76.38 -45.37 34.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.244 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.433 ' H ' HG13 ' A' ' 108' ' ' ILE . 2.1 mt -57.87 -61.44 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.63 0 CA-C-O 121.669 0.747 . . . . 0.0 109.516 179.367 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.8 m -51.76 -28.81 16.49 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.284 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 3.9 mtt180 -64.41 -35.35 80.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.524 179.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -92.77 -28.86 16.32 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.781 179.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.405 ' CE ' HG21 ' A' ' 108' ' ' ILE . 2.0 mptp? -70.53 -39.65 73.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.75 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -63.28 -37.99 89.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.852 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.76 -33.39 75.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.018 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 43.8 t0 . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.192 -0.908 . . . . 0.0 111.237 179.907 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 8.1 tp . . . . . 0 N--CA 1.487 1.418 0 CA-C-O 120.795 0.331 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 2.0 m -134.75 162.3 58.53 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.992 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_exo -51.63 -42.59 55.54 Favored 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 122.6 2.2 . . . . 0.0 112.379 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -57.42 -29.26 63.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.971 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -65.74 -40.49 92.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.888 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.418 ' HA ' ' CD1' ' B' ' 53' ' ' TRP . 31.0 mm -70.7 -24.24 24.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.324 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.05 -34.13 77.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.058 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.33 -29.77 70.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.192 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 53' ' ' TRP . . . . . 0.429 ' CD2' ' HD2' ' A' ' 57' ' ' LYS . 28.7 m95 -54.96 -28.87 54.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.977 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 54' ' ' PHE . . . . . 0.419 ' CZ ' ' HG2' ' A' ' 61' ' ' ARG . 65.3 m-85 -115.55 -13.35 11.55 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.444 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -84.03 -28.25 27.79 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.677 0.275 . . . . 0.0 110.795 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -73.63 115.48 13.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.837 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -148.49 164.51 21.41 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.874 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo . . . . . 0 C--O 1.249 1.051 0 C-N-CA 122.621 2.214 . . . . 0.0 112.355 179.923 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo . . . . . 0 N--CA 1.477 0.526 0 CA-C-O 120.886 0.286 . . . . 0.0 111.831 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.0 m -65.67 -29.08 69.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.07 179.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.408 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 66.3 m80 -141.35 34.99 1.67 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.136 0.493 . . . . 0.0 110.963 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.483 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 6.2 p -173.32 116.75 0.27 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.877 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -146.57 117.67 0.97 Allowed Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.391 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.599 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -41.38 108.69 0.1 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.178 0.513 . . . . 0.0 111.673 -179.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.44 ' O ' ' O ' ' A' ' 14' ' ' GLY . . . -122.35 153.04 39.52 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.974 -178.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.521 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -100.11 125.53 53.82 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.236 0 CA-C-O 120.956 0.408 . . . . 0.0 110.35 178.881 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.508 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 5.7 t80 -113.1 130.85 56.04 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.134 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 55.4 34.29 22.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.9 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 30.9 mttm 76.28 1.21 3.37 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.322 -179.046 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.512 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.6 t -99.69 154.29 4.27 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.641 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 178.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.521 ' HA ' HG13 ' A' ' 8' ' ' ILE . 90.6 p -95.65 149.2 21.72 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.579 0.704 . . . . 0.0 112.613 -178.671 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.44 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 175.42 -179.62 46.53 Favored Glycine 0 N--CA 1.446 -0.648 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.347 -179.797 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.599 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.71 142.65 19.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 117.608 0.704 . . . . 0.0 110.68 179.367 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.483 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.2 OUTLIER -106.77 118.49 54.62 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.764 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 179.48 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -118.28 123.91 46.55 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.334 -178.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.428 HD13 HG23 ' A' ' 18' ' ' ILE . 42.2 mt -96.74 138.46 21.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.995 -179.403 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 65.9 m-20 -131.03 114.2 14.89 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.988 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -91.92 5.93 48.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.169 179.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -78.95 -18.13 54.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.957 0.408 . . . . 0.0 110.313 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.78 145.24 10.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.886 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.0 t -119.44 115.65 33.96 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.967 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.41 ' HB2' ' CB ' ' A' ' 43' ' ' SER . 79.7 Cg_endo -78.06 146.3 80.54 Favored 'Cis proline' 0 C--N 1.348 0.53 0 C-N-CA 123.42 -1.492 . . . . 0.0 112.193 0.132 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.63 137.69 8.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.629 179.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -127.3 167.05 16.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.153 0.501 . . . . 0.0 111.701 -179.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.0 tt -121.16 130.58 53.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.8 179.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.3 m -116.6 123.93 48.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.117 0.484 . . . . 0.0 111.907 -179.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.475 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 58.5 t90 -100.63 128.93 46.51 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.073 179.311 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 8.5 ttm180 -124.68 116.32 22.18 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.824 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.434 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 28.8 t -45.24 164.13 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.091 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.51 -41.42 65.94 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.498 0.666 . . . . 0.0 109.611 179.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -81.13 -22.08 39.32 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.075 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.29 33.25 10.75 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.447 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -107.33 -21.12 13.05 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.658 0.266 . . . . 0.0 111.489 -179.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -127.2 134.41 50.13 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.862 0.363 . . . . 0.0 111.176 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.4 t -139.13 136.19 42.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.939 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.508 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 85.7 t60 -138.81 146.21 41.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.217 0.532 . . . . 0.0 111.387 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 49.6 m -126.09 139.41 53.41 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.893 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 95.8 t -131.77 140.87 47.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.094 0.474 . . . . 0.0 111.637 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.522 ' CG1' ' CG2' ' A' ' 44' ' ' THR . 1.4 p -85.35 118.06 31.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 178.022 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.461 ' HA ' HG12 ' A' ' 45' ' ' ILE . 61.2 mt -72.38 -30.23 64.49 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.212 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.41 ' CB ' ' HB2' ' A' ' 24' ' ' PRO . 2.3 t -53.91 -23.66 13.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.682 0.277 . . . . 0.0 111.641 -179.516 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.522 ' CG2' ' CG1' ' A' ' 41' ' ' VAL . 0.2 OUTLIER -84.56 -25.49 28.66 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.137 -179.855 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.461 HG12 ' HA ' ' A' ' 42' ' ' LEU . 45.6 mm -54.33 101.39 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.129 -179.505 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -95.78 -20.66 18.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.54 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.436 ' HB2' HG13 ' A' ' 63' ' ' ILE . 35.8 mttt -153.39 133.43 13.3 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.009 0.433 . . . . 0.0 111.302 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 54.0 mt -105.81 124.28 49.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.632 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -109.66 130.39 55.52 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.467 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -142.05 142.07 32.83 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.98 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 81.3 p -75.75 137.71 70.09 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.57 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.16 152.95 55.89 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.583 2.189 . . . . 0.0 112.503 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.01 -43.0 99.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.181 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.1 m -58.01 -27.63 63.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.697 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.4 m -82.35 119.99 24.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.795 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -57.2 -18.27 14.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.456 179.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.424 ' HB3' ' CE3' ' B' ' 53' ' ' TRP . 32.0 mmtt -58.46 134.49 56.71 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.045 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 30.5 mmm -122.15 100.56 7.03 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.48 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -174.81 145.15 0.85 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.008 0.432 . . . . 0.0 111.784 -179.659 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 tt -126.22 131.46 51.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.107 179.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.429 ' HB2' ' CZ ' ' B' ' 54' ' ' PHE . 0.0 OUTLIER -112.79 124.05 51.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.96 0.41 . . . . 0.0 111.959 -179.071 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.428 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.4 OUTLIER -92.91 143.53 26.16 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.973 178.753 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.436 HG13 ' HB2' ' A' ' 47' ' ' LYS . 1.1 mm -118.55 120.47 64.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.263 -179.625 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -88.79 147.01 19.57 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.068 179.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -59.38 135.35 57.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.9 0.381 . . . . 0.0 111.077 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.487 ' CG2' ' N ' ' A' ' 67' ' ' ASP . 1.8 p -77.88 161.13 4.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.415 0.626 . . . . 0.0 111.563 -179.809 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.487 ' N ' ' CG2' ' A' ' 66' ' ' VAL . 91.2 m-20 -90.77 77.51 6.26 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.627 179.628 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -63.56 -15.98 59.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.377 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 34.0 m -55.26 -21.98 16.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.808 0.337 . . . . 0.0 111.072 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.6 mmtp -78.81 -68.23 0.67 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.864 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.1 mttp 59.86 92.98 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.988 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.422 ' O ' ' N ' ' A' ' 80' ' ' VAL . 20.0 mtm-85 -93.49 -176.95 4.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.414 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -125.82 153.78 43.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.982 0.42 . . . . 0.0 111.165 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -87.03 168.39 13.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.816 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -58.47 -21.05 50.16 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.4 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -90.99 7.53 39.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.614 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.82 -11.91 68.97 Favored Glycine 0 C--N 1.332 0.339 0 C-N-CA 120.511 -0.852 . . . . 0.0 112.755 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -66.72 175.48 2.37 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.74 0.305 . . . . 0.0 110.829 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -96.66 163.76 12.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.924 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.422 ' N ' ' O ' ' A' ' 72' ' ' ARG . 22.1 t -135.72 157.78 39.16 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 CA-C-O 121.519 0.676 . . . . 0.0 111.869 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.6 t -124.73 97.89 38.06 Favored Pre-proline 0 C--N 1.32 -0.715 0 CA-C-N 114.819 -1.082 . . . . 0.0 108.354 177.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -45.05 166.24 0.05 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.253 1.969 . . . . 0.0 112.61 -178.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.507 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 1.1 mtmm -84.53 137.16 39.08 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 120.934 0.397 . . . . 0.0 110.958 -179.752 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.507 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 10.1 Cg_exo -76.23 165.78 28.87 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 123.367 2.711 . . . . 0.0 112.613 -179.119 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -65.5 156.1 33.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.534 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 66.7 mtm180 -148.68 133.25 17.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.82 0.343 . . . . 0.0 111.154 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.408 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 46.6 m-70 -116.31 159.03 22.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.503 179.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.3 ttt -125.69 142.1 51.68 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.996 0.427 . . . . 0.0 111.37 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.5 ' CE2' ' CD1' ' A' ' 9' ' ' PHE . 95.9 m-85 -152.02 125.81 9.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.514 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.3 t -101.61 143.02 32.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.989 0.423 . . . . 0.0 111.18 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.484 ' CG ' ' HG3' ' A' ' 97' ' ' MET . 54.2 m-85 -130.09 172.48 11.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.671 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 74.8 m-20 -132.36 23.38 4.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.184 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -154.08 116.43 4.34 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.832 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 9.0 mtt85 -57.73 -31.46 66.47 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.001 0.429 . . . . 0.0 110.751 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.03 -54.99 18.99 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.724 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 61.8 t -61.56 -37.55 78.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.186 179.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.484 ' HG3' ' CG ' ' A' ' 91' ' ' PHE . 1.4 ttp -69.3 -33.19 72.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.392 179.352 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.444 ' O ' ' HB3' ' A' ' 102' ' ' MET . 22.0 t70 -72.41 -25.13 61.37 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.146 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -80.98 -51.59 8.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.977 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.444 HD12 ' CG2' ' A' ' 16' ' ' ILE . 16.8 mm -53.83 -52.07 38.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.027 0.442 . . . . 0.0 110.782 179.695 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.59 -27.86 68.04 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.93 179.726 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.444 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.8 OUTLIER -78.78 -43.96 24.3 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.902 -179.972 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.424 HG23 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -69.84 -44.31 70.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.087 -179.546 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 16.2 mt -58.33 -38.96 78.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.832 0.349 . . . . 0.0 110.971 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -63.09 -28.72 70.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.961 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -68.49 -37.21 79.9 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.819 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.407 ' CD1' ' CD1' ' A' ' 42' ' ' LEU . 3.4 mt -68.68 -44.55 82.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.335 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.433 ' H ' HG13 ' A' ' 108' ' ' ILE . 2.1 mt -59.96 -61.02 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.618 0 CA-C-O 121.7 0.762 . . . . 0.0 109.319 179.024 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.5 t -50.6 -29.27 10.46 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.392 -1.276 . . . . 0.0 110.903 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 51.1 mtt180 -67.88 -33.81 75.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.079 0.466 . . . . 0.0 110.52 179.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -105.47 -0.97 25.45 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.911 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.93 -33.15 7.01 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.839 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -61.79 -36.6 81.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.728 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.12 -33.78 75.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.049 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.846 -179.987 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 10.0 tp . . . . . 0 N--CA 1.487 1.413 0 CA-C-O 120.81 0.338 . . . . 0.0 111.097 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.4 m -119.33 163.15 28.46 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.834 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.69 -36.34 92.22 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.604 2.203 . . . . 0.0 112.257 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 50.9 p30 -59.63 -16.83 28.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.037 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -77.77 -40.27 41.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.267 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 32.8 mm -71.65 -29.63 35.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.731 -179.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -77.82 -26.24 49.41 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.131 -179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -59.17 -30.17 67.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.793 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 53' ' ' TRP . . . . . 0.424 ' CE3' ' HB3' ' A' ' 57' ' ' LYS . 14.0 m95 -62.92 -35.28 79.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.871 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 54' ' ' PHE . . . . . 0.429 ' CZ ' ' HB2' ' A' ' 61' ' ' ARG . 82.6 m-85 -99.18 -0.29 41.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.42 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.71 -32.58 74.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.75 0.31 . . . . 0.0 110.855 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -60.03 135.13 57.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.9 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -149.6 85.6 5.67 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.934 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo . . . . . 0 C--O 1.249 1.067 0 C-N-CA 122.622 2.214 . . . . 0.0 112.286 -179.965 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo . . . . . 0 N--CA 1.475 0.424 0 CA-C-O 120.844 0.268 . . . . 0.0 111.787 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.5 t 58.4 107.09 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.027 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 76.2 m80 63.59 33.33 13.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.111 0.482 . . . . 0.0 111.14 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.578 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 64.2 p 178.25 171.83 0.71 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.841 179.139 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 155.78 119.15 0.63 Allowed Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.21 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.587 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -47.07 108.73 0.16 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.101 0.476 . . . . 0.0 111.404 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.461 ' CB ' ' CE2' ' A' ' 91' ' ' PHE . . . -123.7 153.18 41.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.81 -178.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.541 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.9 OUTLIER -99.72 124.36 53.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.976 0.417 . . . . 0.0 110.419 179.021 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.505 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 19.7 t80 -113.19 129.83 56.4 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.085 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.418 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 83.8 mt-10 57.08 34.46 24.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.894 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 29.2 mmtt 75.77 1.93 3.63 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.24 -179.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.521 ' O ' HG22 ' A' ' 8' ' ' ILE . 40.9 t -100.78 154.39 4.58 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.634 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.541 ' HA ' HG13 ' A' ' 8' ' ' ILE . 79.9 p -96.67 148.7 22.6 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-O 121.557 0.694 . . . . 0.0 112.517 -178.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.449 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.15 -179.74 46.22 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-N 114.649 -1.16 . . . . 0.0 110.404 -179.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.587 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.41 141.55 21.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 117.611 0.706 . . . . 0.0 110.602 179.378 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.578 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -106.75 118.57 54.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 179.53 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.462 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -119.8 139.83 51.72 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.19 -178.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.425 ' CD1' HG21 ' A' ' 103' ' ' THR . 94.1 mt -116.51 140.04 40.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.501 -178.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -125.56 111.37 14.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.7 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -94.21 7.88 43.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.244 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -80.43 -17.91 50.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.814 0.34 . . . . 0.0 110.346 179.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.49 ' CG2' ' N ' ' A' ' 23' ' ' SER . 0.6 OUTLIER -106.93 159.27 6.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.201 0.524 . . . . 0.0 111.227 -179.995 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.49 ' N ' ' CG2' ' A' ' 22' ' ' VAL . 7.1 m -131.27 121.54 18.61 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.811 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -76.51 137.58 49.85 Favored 'Cis proline' 0 C--N 1.348 0.504 0 C-N-CA 123.529 -1.446 . . . . 0.0 111.873 -0.063 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -44.74 140.8 2.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.679 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.405 ' CA ' HD22 ' A' ' 42' ' ' LEU . 77.5 mt-10 -127.36 158.48 37.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.324 0.583 . . . . 0.0 112.046 -178.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.449 ' O ' ' HA ' ' A' ' 39' ' ' THR . 4.2 tt -121.39 129.9 53.3 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.127 179.064 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.0 m -121.05 125.95 48.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.255 0.55 . . . . 0.0 112.334 -178.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.469 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 63.6 t90 -100.6 128.39 46.67 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.647 178.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 55.2 ttt-85 -125.59 118.16 25.12 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.863 0.363 . . . . 0.0 111.02 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.449 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 33.3 m -45.63 166.58 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.92 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.02 -41.68 67.26 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.47 0.652 . . . . 0.0 109.754 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -100.37 -9.84 21.83 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.852 -1.067 . . . . 0.0 111.209 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 91.73 26.86 18.68 Favored Glycine 0 C--N 1.331 0.299 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.391 -179.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -71.61 -24.02 61.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.742 0.306 . . . . 0.0 111.673 -179.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.51 153.87 19.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.08 0.467 . . . . 0.0 111.489 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.8 t -139.04 132.81 39.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.699 179.593 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.505 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 43.3 t60 -133.76 145.9 50.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.195 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.449 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 52.2 m -129.04 140.18 51.72 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.303 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 90.9 t -134.56 141.62 42.87 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.197 0 CA-C-O 121.152 0.501 . . . . 0.0 111.982 179.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -88.36 117.43 31.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.719 177.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.407 ' H ' ' CD2' ' A' ' 42' ' ' LEU . 0.1 OUTLIER -68.3 -19.87 64.72 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 120.784 0.326 . . . . 0.0 110.502 179.464 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 86.0 p -65.03 -28.28 69.38 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.07 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -86.71 -26.5 24.21 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.715 179.725 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 45.9 mm -57.24 91.31 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.036 -179.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -60.83 -30.58 70.19 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.035 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.618 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 35.4 mttt -152.36 157.44 41.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.927 0.394 . . . . 0.0 111.21 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.451 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -131.34 126.03 34.23 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.934 179.456 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -122.24 141.19 51.75 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.01 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.412 ' CB ' ' CD1' ' A' ' 60' ' ' LEU . . . -136.99 147.86 46.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.046 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 20.1 p -75.82 124.02 88.48 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.743 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.53 160.62 49.08 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.378 2.052 . . . . 0.0 112.408 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.68 -35.22 72.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.081 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.6 t -58.49 -25.84 62.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.005 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 32.7 t -98.57 115.01 27.68 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.822 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -58.26 -18.41 26.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.693 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.421 ' HE3' ' CG ' ' B' ' 53' ' ' TRP . 4.8 mtmm -71.45 97.37 1.63 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.985 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 12.0 mmm -82.1 108.27 15.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.765 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.445 ' CE ' ' CE3' ' B' ' 53' ' ' TRP . 1.3 tmm? -176.52 145.6 0.57 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.108 0.48 . . . . 0.0 111.742 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.474 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -115.69 159.99 20.65 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.938 179.354 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.421 ' HB2' ' CE2' ' B' ' 54' ' ' PHE . 7.3 tpt180 -145.86 127.72 15.4 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -179.632 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.466 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.56 144.17 32.69 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.316 179.126 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.618 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 2.4 mm -103.65 114.32 42.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.744 0.306 . . . . 0.0 111.416 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -79.32 129.19 8.99 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.106 179.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 20.6 mttt -52.03 148.14 6.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.939 0.4 . . . . 0.0 111.197 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.502 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 2.1 p -108.76 -162.34 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.876 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.502 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 5.7 t70 -156.7 71.49 0.69 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.97 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.0 mp0 -55.67 -21.56 18.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.466 -179.263 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.1 t -56.83 -19.68 18.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.084 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 32.3 mmtt -72.45 -47.67 47.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.978 0.418 . . . . 0.0 110.89 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.2 mmtt 62.85 94.7 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.923 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 15.0 mtt-85 -99.51 143.86 29.27 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.944 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.8 mmtp -87.48 145.66 26.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.005 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 43.6 p30 -97.44 177.6 5.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.107 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -60.99 -19.36 61.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.302 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -88.38 11.41 16.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.516 -179.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 68.67 17.62 71.24 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.708 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -117.09 146.24 43.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.94 0.4 . . . . 0.0 110.876 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -70.71 144.28 51.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.97 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.435 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.8 m -140.51 158.76 24.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.195 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 18.6 t -83.31 110.37 23.62 Favored Pre-proline 0 C--N 1.327 -0.378 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.435 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 71.7 Cg_exo -48.58 145.9 11.66 Favored 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 122.094 1.862 . . . . 0.0 112.668 -178.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.464 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 29.0 mttm -74.66 102.93 0.74 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.135 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.464 ' HD2' ' HA ' ' A' ' 83' ' ' LYS . 1.0 OUTLIER -40.17 149.38 0.14 Allowed 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 123.534 2.823 . . . . 0.0 112.642 179.275 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.36 155.15 36.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.771 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 55.6 mtt85 -153.49 119.83 5.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.68 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 84.4 m-70 -93.5 154.49 17.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.643 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.4 ttt -130.88 118.97 21.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.905 0.383 . . . . 0.0 111.484 -179.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.487 ' CE2' ' CD1' ' A' ' 9' ' ' PHE . 94.4 m-85 -127.73 125.47 40.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.215 179.478 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.98 131.44 44.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.995 0.426 . . . . 0.0 111.211 -179.538 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.474 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 12.1 m-85 -121.08 161.44 21.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.611 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -124.63 29.34 6.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.009 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 74.8 m-80 -156.6 112.32 2.94 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.795 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.71 -28.17 20.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.05 0.453 . . . . 0.0 111.044 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -77.43 -54.91 5.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.853 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 40.3 t -56.31 -44.76 80.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.87 -179.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -65.84 -35.97 82.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.115 179.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -66.64 -33.01 74.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.562 179.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.411 ' O ' ' HB ' ' A' ' 103' ' ' THR . 76.6 m-20 -63.49 -35.43 80.41 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.874 179.309 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.461 HG13 ' CE2' ' A' ' 91' ' ' PHE . 21.5 mm -71.07 -51.99 30.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.577 179.362 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 11.3 pttp -64.53 -27.23 68.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.614 179.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 44.1 mtm -78.21 -38.36 43.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.521 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.425 HG21 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -78.61 -38.11 40.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.611 179.728 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 12.0 mt -63.54 -40.36 96.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.592 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -62.99 -27.4 69.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.979 0.419 . . . . 0.0 111.04 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -70.41 -38.65 74.66 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.151 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.425 ' O ' ' HB2' ' A' ' 110' ' ' ARG . 60.8 mt -68.81 -46.68 79.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.543 -179.654 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.418 ' H ' HG13 ' A' ' 108' ' ' ILE . 2.6 mt -56.61 -60.17 2.22 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.621 0 CA-C-O 121.84 0.828 . . . . 0.0 109.507 179.187 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.7 m -48.78 -29.0 4.05 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.107 -1.406 . . . . 0.0 111.389 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.425 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 50.7 mtt-85 -70.82 -32.31 69.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.046 0.45 . . . . 0.0 110.809 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -95.6 -30.85 13.57 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.018 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.406 ' CD ' ' CG2' ' A' ' 108' ' ' ILE . 0.0 OUTLIER -68.15 -36.87 80.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.577 179.709 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -62.28 -37.99 87.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.924 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.9 -34.55 78.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.06 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 22.8 t70 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.896 -179.945 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 7.2 tt . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.817 0.341 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 17.0 p -121.19 164.03 26.45 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.821 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_exo -51.34 -43.25 50.54 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.575 2.184 . . . . 0.0 112.383 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -59.28 -29.05 67.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.815 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -63.86 -45.73 88.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.806 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 34.0 mm -67.51 -27.87 40.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.244 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -68.07 -33.31 74.31 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.843 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -29.95 71.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.09 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 53' ' ' TRP . . . . . 0.445 ' CE3' ' CE ' ' A' ' 59' ' ' MET . 11.4 m0 -57.72 -29.61 64.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.193 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 54' ' ' PHE . . . . . 0.421 ' CE2' ' HB2' ' A' ' 61' ' ' ARG . 98.2 m-85 -98.47 -15.63 19.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.554 -179.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.41 -30.57 60.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.818 0.342 . . . . 0.0 110.857 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 21.3 pt-20 -61.01 139.01 58.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.924 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 62.57 147.86 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.869 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo . . . . . 0 C--O 1.249 1.052 0 C-N-CA 122.511 2.141 . . . . 0.0 112.341 179.934 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo . . . . . 0 N--CA 1.476 0.457 0 CA-C-O 120.92 0.3 . . . . 0.0 111.799 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.3 t -160.58 119.52 2.64 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.727 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 59.3 m80 65.08 32.94 9.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.077 179.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.514 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 60.4 p -175.01 164.58 3.39 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.767 179.239 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 160.87 117.93 0.46 Allowed Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.383 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.58 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -47.06 110.46 0.3 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.085 0.469 . . . . 0.0 111.459 -179.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.449 ' O ' ' O ' ' A' ' 14' ' ' GLY . . . -125.61 150.78 47.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.632 -179.064 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.544 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -99.51 124.99 53.19 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-O 121.014 0.435 . . . . 0.0 110.443 179.332 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.515 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 7.1 t80 -112.93 130.73 56.01 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.163 179.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 55.88 34.28 23.25 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.944 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 78.7 mttt 76.11 1.5 3.45 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.274 -179.09 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.525 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.6 t -100.16 154.62 4.36 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.586 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.013 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.544 ' HA ' HG13 ' A' ' 8' ' ' ILE . 89.2 p -96.47 149.15 22.05 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.638 0.733 . . . . 0.0 112.785 -178.487 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.449 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 175.23 -179.77 46.27 Favored Glycine 0 N--CA 1.445 -0.705 0 CA-C-N 114.436 -1.256 . . . . 0.0 110.298 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.58 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.57 143.39 17.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 117.73 0.765 . . . . 0.0 110.438 179.352 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.514 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -106.75 118.3 54.22 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.682 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.625 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.464 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -121.64 133.82 54.98 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.345 -178.588 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.433 ' CD1' HG21 ' A' ' 103' ' ' THR . 90.6 mt -106.33 140.1 25.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.184 -179.028 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -131.99 111.4 11.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.904 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -89.77 6.26 42.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.312 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -79.02 -18.05 54.25 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.906 0.384 . . . . 0.0 110.398 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -98.98 144.25 12.11 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.09 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.9 t -116.47 116.32 39.2 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.755 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.404 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 1.8 Cg_endo -80.01 143.8 67.41 Favored 'Cis proline' 0 C--N 1.349 0.562 0 C-N-CA 123.819 -1.326 . . . . 0.0 111.883 -0.05 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.56 140.68 4.19 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.884 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -134.25 167.21 21.12 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.251 0.548 . . . . 0.0 111.746 -179.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.0 tt -121.18 128.17 52.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.674 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.3 m -115.72 128.55 55.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.174 0.511 . . . . 0.0 112.339 -178.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.465 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 57.2 t90 -100.53 130.1 46.56 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.461 -0.791 . . . . 0.0 109.714 178.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 17.0 ttt180 -124.45 115.72 21.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.831 0.348 . . . . 0.0 110.947 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.421 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 3.8 p -45.45 166.38 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.109 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.65 -42.0 59.32 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 121.416 0.627 . . . . 0.0 109.792 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 48.7 p30 -81.94 -19.44 40.7 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.313 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.89 33.88 11.89 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.271 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -108.54 -21.37 12.75 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.731 0.271 . . . . 0.0 111.731 -179.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.27 134.52 48.96 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.885 0.374 . . . . 0.0 111.103 -179.793 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 12.2 p -139.3 137.79 40.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.063 179.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.515 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 56.5 t60 -136.97 146.05 44.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.144 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 46.9 m -127.82 134.03 49.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.172 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.7 t -124.33 140.8 46.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.367 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.465 ' CG1' HG23 ' A' ' 44' ' ' THR . 2.0 p -85.3 117.61 30.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.12 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.41 ' HA ' HG12 ' A' ' 45' ' ' ILE . 83.5 mt -75.38 -29.67 59.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.982 -178.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.416 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 10.9 t -55.49 -22.16 19.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.867 -179.2 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.465 HG23 ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -95.49 -22.14 17.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.719 0.295 . . . . 0.0 111.195 -179.896 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.41 HG12 ' HA ' ' A' ' 42' ' ' LEU . 36.7 mm -57.11 89.3 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.886 -179.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -74.32 -27.88 60.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.506 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.693 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 28.6 mtpt -141.13 146.04 36.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.132 0.492 . . . . 0.0 111.769 -179.289 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.455 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 0.1 OUTLIER -132.33 124.95 29.8 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.607 179.301 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -127.28 145.05 50.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.943 0.401 . . . . 0.0 111.552 -178.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -133.2 156.98 46.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.836 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.416 HG22 ' CE1' ' B' ' 54' ' ' PHE . 46.5 p -75.74 133.52 73.26 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.528 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.7 154.98 51.24 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.631 2.221 . . . . 0.0 112.557 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.33 -42.98 99.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.155 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.4 m -58.34 -27.53 64.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.09 0.472 . . . . 0.0 110.737 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 29.4 t -81.99 119.85 24.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.811 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -56.84 -18.44 13.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.438 179.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.425 ' HD2' ' CE3' ' B' ' 53' ' ' TRP . 24.6 mmtm -61.01 149.38 36.99 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.944 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.404 ' CE ' ' N ' ' A' ' 93' ' ' ASN . 15.6 mmm -133.78 79.98 1.85 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.672 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.425 ' HE1' ' CD2' ' B' ' 53' ' ' TRP . 0.6 OUTLIER -147.62 169.11 20.34 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.06 0.457 . . . . 0.0 112.037 -179.541 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.69 131.13 19.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.872 179.47 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -113.48 132.34 55.7 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.043 0.449 . . . . 0.0 112.211 -178.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.468 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -110.48 140.64 44.55 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.229 179.246 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.693 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.2 mm -111.82 127.33 69.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.772 0.32 . . . . 0.0 111.328 179.72 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.56 129.66 9.98 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.217 179.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.6 mttt -44.35 145.63 0.79 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.833 0.349 . . . . 0.0 111.413 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.432 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.2 p -117.73 -162.05 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.815 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.432 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 7.3 t0 -178.81 50.44 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.503 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -57.59 -22.5 45.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.334 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 23.7 t -62.1 -16.11 50.04 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.944 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.1 mttt -69.7 -39.95 76.6 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.094 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.8 mtmt 60.43 90.96 0.06 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.813 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 74.3 mmt-85 -94.4 143.88 26.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.022 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 45.4 mmtt -88.14 145.86 25.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.905 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -94.49 173.21 7.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.894 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -60.33 -20.03 57.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.23 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -86.64 4.79 38.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.426 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.3 15.22 81.73 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.606 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -111.72 144.69 40.6 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.812 0.339 . . . . 0.0 110.99 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -71.76 148.01 46.75 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.044 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.425 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 1.5 m -131.01 158.82 43.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.95 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 38.9 t -103.64 98.58 13.18 Favored Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.749 178.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.425 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 86.8 Cg_exo -46.2 162.61 0.12 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.411 2.074 . . . . 0.0 112.419 -179.106 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.486 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -117.8 143.79 33.19 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.745 179.928 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 15.2 Cg_exo -73.47 148.29 42.55 Favored 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 123.453 2.768 . . . . 0.0 112.695 -179.087 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -76.61 147.88 37.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.759 179.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.8 mtp180 -150.93 121.84 7.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.959 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -110.17 146.99 34.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.627 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -129.61 135.73 48.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.31 -179.723 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.496 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 97.7 m-85 -135.6 153.98 51.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.811 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.416 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.4 OUTLIER -126.55 123.89 38.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.912 0.387 . . . . 0.0 110.871 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.473 ' CD1' ' N ' ' A' ' 91' ' ' PHE . 2.2 m-85 -112.87 172.74 6.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.808 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 23.6 p30 -124.69 26.35 7.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.218 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.404 ' N ' ' CE ' ' A' ' 58' ' ' MET . 80.4 m-20 -158.07 122.02 4.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.97 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -56.91 -35.18 68.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.191 0.519 . . . . 0.0 110.693 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.34 -50.26 60.71 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.014 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 52.4 t -59.48 -39.5 79.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.535 179.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.463 ' HG3' ' CG ' ' A' ' 91' ' ' PHE . 2.0 mtp -65.84 -36.58 83.86 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.525 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -68.96 -34.52 75.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.837 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.401 ' O ' ' HB ' ' A' ' 103' ' ' THR . 62.9 m-20 -61.5 -42.65 99.12 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.255 179.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.456 HG13 ' CE2' ' A' ' 91' ' ' PHE . 23.9 mm -66.49 -51.44 57.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.543 179.422 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.52 -27.2 68.29 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.646 179.626 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.1 mmm -78.19 -37.5 45.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.445 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.433 HG21 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -80.69 -36.8 31.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.666 179.761 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 13.0 mt -63.64 -41.48 98.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.758 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -62.42 -28.46 69.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.022 179.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -69.53 -32.76 71.78 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.035 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.403 ' CD1' ' CD1' ' A' ' 42' ' ' LEU . 5.6 mt -75.11 -45.2 42.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.38 -179.675 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.416 ' H ' HG13 ' A' ' 108' ' ' ILE . 1.9 mt -58.32 -61.13 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.556 0 CA-C-O 121.769 0.795 . . . . 0.0 109.428 179.282 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.4 m -50.72 -28.72 9.69 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.376 -1.284 . . . . 0.0 110.637 179.24 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.3 ttm180 -70.11 -48.31 58.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.263 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.416 ' CE2' ' HA ' ' A' ' 43' ' ' SER . 26.6 m-85 -74.44 -29.09 61.34 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.415 179.66 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 2.2 mttt -63.35 -45.39 91.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.587 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -58.66 -36.6 74.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.937 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.63 -33.06 74.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.137 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 23.3 t70 . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.899 179.98 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 25.0 tp . . . . . 0 N--CA 1.486 1.332 0 CA-C-O 120.908 0.385 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 3.2 m -128.91 164.8 36.39 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.948 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -52.73 -33.74 61.28 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.576 2.184 . . . . 0.0 112.343 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -57.15 -22.75 42.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.039 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -80.82 -36.1 32.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.264 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 42.1 mm -81.54 -29.01 10.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.843 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 19.9 pt-20 -67.0 -28.88 68.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.979 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -60.35 -36.77 78.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.664 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 53' ' ' TRP . . . . . 0.425 ' CE3' ' HD2' ' A' ' 57' ' ' LYS . 44.7 m95 -58.93 -30.74 68.09 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.823 -179.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 54' ' ' PHE . . . . . 0.416 ' CE1' HG22 ' A' ' 51' ' ' THR . 95.0 m-85 -99.81 -0.88 38.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.253 179.624 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -105.71 -40.58 5.7 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.85 0.357 . . . . 0.0 110.915 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -59.61 141.14 55.61 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.027 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -142.13 162.32 46.18 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.886 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo . . . . . 0 C--O 1.25 1.082 0 C-N-CA 122.544 2.163 . . . . 0.0 112.322 -179.997 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo . . . . . 0 N--CA 1.476 0.443 0 CA-C-O 120.871 0.28 . . . . 0.0 111.783 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.9 t -177.87 -72.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.912 -179.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.426 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 48.3 m80 -115.05 34.52 4.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.196 0.522 . . . . 0.0 110.93 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.489 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 19.2 p -171.29 141.91 1.65 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.59 179.154 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -172.54 118.19 0.7 Allowed Glycine 0 N--CA 1.446 -0.683 0 C-N-CA 120.531 -0.842 . . . . 0.0 112.429 179.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.593 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -45.68 103.25 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.122 0.487 . . . . 0.0 111.375 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.464 ' O ' ' O ' ' A' ' 14' ' ' GLY . . . -119.4 153.78 34.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.813 -178.914 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.533 HG22 ' O ' ' A' ' 12' ' ' VAL . 1.0 OUTLIER -99.98 126.59 53.43 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.255 0 CA-C-O 121.076 0.465 . . . . 0.0 110.372 178.968 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.505 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 22.2 t80 -114.68 128.12 56.14 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.03 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.417 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 82.8 mt-10 58.02 37.87 26.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.684 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 10' ' ' GLU . 2.3 mmtt 72.01 2.94 4.5 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.567 -179.153 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.533 ' O ' HG22 ' A' ' 8' ' ' ILE . 39.6 t -101.83 155.19 4.84 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.582 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 178.78 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.53 ' HA ' HG13 ' A' ' 8' ' ' ILE . 96.4 p -96.57 149.07 22.18 Favored 'General case' 0 C--N 1.313 -1.022 0 CA-C-O 121.594 0.712 . . . . 0.0 112.617 -178.557 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.464 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 175.64 -179.59 46.73 Favored Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 114.603 -1.18 . . . . 0.0 110.347 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.593 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.62 141.97 20.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 117.732 0.766 . . . . 0.0 110.53 179.413 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.489 ' O ' ' HA ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -106.68 118.38 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 179.551 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -119.64 135.0 54.99 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.353 -178.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.437 ' CD1' HG23 ' A' ' 103' ' ' THR . 69.6 mt -107.16 140.12 26.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.597 -0.728 . . . . 0.0 111.171 -179.01 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 70.0 m-20 -132.08 113.25 13.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.925 -179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -90.83 6.11 45.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.169 179.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 86.3 m-20 -79.48 -17.68 53.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.004 0.431 . . . . 0.0 110.478 179.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.68 143.77 13.15 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.985 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.8 t -116.94 116.16 38.21 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.867 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.403 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 2.0 Cg_endo -79.82 144.0 68.92 Favored 'Cis proline' 0 C--N 1.348 0.529 0 C-N-CA 123.782 -1.341 . . . . 0.0 111.954 0.049 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -45.68 140.68 3.27 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.014 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 68.5 mt-10 -133.62 167.11 21.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.247 0.546 . . . . 0.0 111.654 -179.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.3 tt -121.18 131.81 54.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.713 179.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.4 m -118.32 126.98 53.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.072 0.463 . . . . 0.0 112.093 -178.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.482 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 60.0 t90 -100.52 130.2 46.56 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.974 179.13 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 8.3 ttt85 -125.28 115.8 20.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.799 0.333 . . . . 0.0 110.912 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.423 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 29.5 t -45.49 166.54 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.142 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.07 -42.08 60.74 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.38 0.61 . . . . 0.0 109.663 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 89.7 m-20 -80.07 -22.72 41.94 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.126 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.57 32.96 10.67 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.469 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -108.31 -19.26 13.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.612 0.244 . . . . 0.0 111.471 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.96 134.95 49.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.791 0.329 . . . . 0.0 111.085 -179.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 11.8 p -138.98 139.09 41.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.11 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.505 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 65.9 t60 -135.82 146.14 47.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.124 0.488 . . . . 0.0 111.253 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 42.0 m -127.52 135.13 49.93 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.846 179.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 99.4 t -130.77 140.82 47.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.012 0.434 . . . . 0.0 111.601 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.453 ' CG1' ' CG2' ' A' ' 44' ' ' THR . 1.4 p -84.98 117.8 30.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 178.121 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.461 ' HA ' HG12 ' A' ' 45' ' ' ILE . 45.3 mt -75.44 -30.14 59.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.969 -178.622 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.413 ' HB2' ' CZ ' ' A' ' 111' ' ' TYR . 11.7 t -55.27 -21.7 15.47 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.096 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.453 ' CG2' ' CG1' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -89.37 -22.97 22.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.795 0.331 . . . . 0.0 111.213 -179.7 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.461 HG12 ' HA ' ' A' ' 42' ' ' LEU . 48.3 mm -48.41 106.49 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.953 0.406 . . . . 0.0 111.206 -179.618 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -99.46 -20.09 16.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.404 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.409 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 51.2 mttp -154.53 133.01 11.99 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.961 0.41 . . . . 0.0 111.419 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 87.4 mt -107.7 124.36 49.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.664 179.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.443 ' NE2' ' CD2' ' B' ' 54' ' ' PHE . 1.7 tt0 -113.78 134.95 54.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.633 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -142.34 144.99 33.45 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.882 0.372 . . . . 0.0 111.19 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.403 ' CG2' ' CE ' ' A' ' 57' ' ' LYS . 72.9 p -75.87 129.99 79.72 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.765 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.5 154.31 74.78 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.538 2.159 . . . . 0.0 112.371 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.95 -34.53 74.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.125 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.1 m -59.08 -27.63 65.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.008 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 71.4 m -82.64 120.29 25.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.965 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -58.5 -17.74 23.56 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.525 179.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.416 ' HB2' ' CZ3' ' B' ' 53' ' ' TRP . 0.0 OUTLIER -84.61 148.2 26.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.184 -179.852 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 17.5 mmm -119.45 128.35 53.92 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.683 -179.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.466 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.6 OUTLIER -179.88 165.25 1.24 Allowed 'General case' 0 N--CA 1.462 0.136 0 CA-C-O 121.251 0.548 . . . . 0.0 112.331 179.771 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.2 tt -148.48 137.3 21.6 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.305 -0.862 . . . . 0.0 109.776 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.421 ' HB2' ' CZ ' ' B' ' 54' ' ' PHE . 0.0 OUTLIER -123.35 126.72 47.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.985 0.421 . . . . 0.0 112.008 -179.186 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.437 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -99.74 139.65 35.08 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.015 179.038 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.409 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 1.0 OUTLIER -118.67 127.89 75.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.164 -179.761 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -95.78 156.79 21.55 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.237 179.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.4 mttp -58.3 157.9 7.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.81 0.338 . . . . 0.0 111.0 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.448 ' CG2' ' H ' ' A' ' 67' ' ' ASP . 1.2 p -121.86 -162.1 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.966 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.448 ' H ' ' CG2' ' A' ' 66' ' ' VAL . 54.1 t0 -172.04 61.88 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.278 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -58.23 -20.79 44.59 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.245 -179.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 37.9 m -57.7 -19.08 24.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.087 179.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -61.68 -47.08 86.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.988 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp 62.64 95.31 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.819 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 42.9 mmt180 -103.18 165.44 11.02 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.816 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -125.55 145.3 50.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.979 0.419 . . . . 0.0 111.103 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -85.22 173.01 10.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.872 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.75 -17.76 61.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.291 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -87.65 6.99 31.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.45 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 81.73 -1.35 86.43 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.596 -0.812 . . . . 0.0 112.751 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -84.0 159.49 21.21 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.732 0.301 . . . . 0.0 110.765 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -95.95 147.6 23.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.864 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.427 ' CG2' ' N ' ' A' ' 81' ' ' VAL . 0.2 OUTLIER -140.56 152.66 21.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.597 0.713 . . . . 0.0 111.255 -179.997 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.43 HG11 ' O ' ' A' ' 81' ' ' VAL . 5.7 p -103.24 100.1 16.74 Favored Pre-proline 0 C--N 1.32 -0.708 0 CA-C-N 114.487 -1.233 . . . . 0.0 110.634 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -46.8 145.27 6.99 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.409 2.073 . . . . 0.0 112.509 -179.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -91.42 151.01 42.28 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.047 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -72.49 161.09 45.14 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 123.466 2.777 . . . . 0.0 112.716 -178.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -65.36 138.1 57.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.749 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.2 mtp-105 -139.81 119.89 13.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.906 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -110.22 157.44 19.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.725 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 3.1 ttt -127.34 140.55 52.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.95 0.405 . . . . 0.0 111.337 -179.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.446 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 97.9 m-85 -150.69 127.77 11.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.572 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.466 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 14.4 t -107.21 132.48 53.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.906 0.384 . . . . 0.0 111.326 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.462 ' CE2' ' CB ' ' A' ' 7' ' ' ALA . 3.4 m-85 -122.29 172.32 8.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.646 179.615 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -128.67 26.21 5.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.966 179.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -152.94 119.64 5.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.524 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -55.13 -34.0 63.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.017 0.437 . . . . 0.0 110.937 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.06 -55.29 6.71 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.124 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 48.1 t -60.02 -41.15 85.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.969 0.414 . . . . 0.0 110.198 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.412 ' HG3' ' CD1' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -67.76 -37.15 81.72 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.529 179.632 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -76.09 -31.3 58.66 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.967 0.413 . . . . 0.0 111.039 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -59.53 -41.35 89.81 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.379 179.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.432 HG13 ' CE2' ' A' ' 91' ' ' PHE . 24.5 mm -65.66 -51.89 57.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.504 179.424 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.4 ' HG3' ' N ' ' A' ' 102' ' ' MET . 0.1 OUTLIER -65.32 -27.13 68.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.476 179.516 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.4 ' N ' ' HG3' ' A' ' 101' ' ' LYS . 43.4 mtm -78.43 -40.28 36.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.708 179.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.437 HG23 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -76.59 -38.83 54.21 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.63 179.846 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.404 ' CD2' ' CD2' ' A' ' 42' ' ' LEU . 6.5 mt -61.19 -38.98 88.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.572 179.735 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.0 -32.33 69.61 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.043 0.449 . . . . 0.0 110.427 179.454 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -66.44 -31.24 71.87 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.056 179.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 10.0 mm -69.22 -56.7 10.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.579 179.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . . . . . . . . . 2.2 mt -50.66 -61.08 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.542 0 CA-C-O 121.783 0.801 . . . . 0.0 109.662 179.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.2 m -51.66 -28.9 15.94 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 114.235 -1.348 . . . . 0.0 110.674 179.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 4.1 mtt-85 -67.33 -40.44 85.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.41 179.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.413 ' CZ ' ' HB2' ' A' ' 43' ' ' SER . 86.5 m-85 -84.35 -28.28 27.14 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.382 179.489 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 20.2 mttt -63.08 -43.0 99.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.497 179.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -61.06 -36.88 80.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.924 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.29 -33.59 74.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.085 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 52.1 t0 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.274 -0.87 . . . . 0.0 110.842 -179.984 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 27.6 tp . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.741 0.305 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.3 m -123.57 163.74 32.76 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.867 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -55.27 -40.53 85.17 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.646 2.231 . . . . 0.0 112.215 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -55.15 -22.31 16.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.871 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -66.92 -42.92 84.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.783 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 24.9 mm -71.0 -24.19 24.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.361 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -62.38 -38.47 89.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.857 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.06 -33.65 75.88 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.729 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 53' ' ' TRP . . . . . 0.451 ' CE3' ' CE ' ' A' ' 59' ' ' MET . 12.1 m95 -59.4 -34.13 72.07 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.133 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 54' ' ' PHE . . . . . 0.443 ' CD2' ' NE2' ' A' ' 49' ' ' GLN . 44.0 m-85 -105.65 -3.64 21.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.701 -179.687 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -91.16 -29.91 16.99 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.805 0.336 . . . . 0.0 110.81 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -80.99 144.28 31.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.844 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 58.76 175.0 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.012 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo . . . . . 0 C--O 1.249 1.027 0 C-N-CA 122.563 2.175 . . . . 0.0 112.305 -179.942 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.3 m . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.799 0.333 . . . . 0.0 110.873 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 35.4 m80 63.29 33.58 13.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.287 0.565 . . . . 0.0 111.08 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.529 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 54.9 p 177.59 129.28 0.05 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.637 179.189 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -164.04 114.47 0.6 Allowed Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.598 -0.811 . . . . 0.0 112.335 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.642 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -43.7 100.57 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.165 0.507 . . . . 0.0 111.436 -179.76 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.821 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -116.54 154.71 29.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.909 -178.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.685 HG23 ' O ' ' A' ' 12' ' ' VAL . 1.0 OUTLIER -101.78 126.63 55.69 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 CA-C-O 121.105 0.479 . . . . 0.0 110.443 178.967 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.499 ' CD1' ' CE2' ' A' ' 89' ' ' PHE . 15.4 t80 -114.0 130.67 56.53 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.208 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.427 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 37.4 mt-10 55.73 35.08 24.63 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.024 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 28.2 mttm 76.24 1.28 3.39 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.394 -179.286 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.685 ' O ' HG23 ' A' ' 8' ' ' ILE . 42.1 t -99.6 156.68 3.94 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.644 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 178.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.554 ' HA ' HG13 ' A' ' 8' ' ' ILE . 91.1 p -98.86 149.68 22.66 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-O 121.435 0.636 . . . . 0.0 112.408 -178.853 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.476 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 174.53 -179.53 45.79 Favored Glycine 0 N--CA 1.447 -0.624 0 N-CA-C 110.281 -1.128 . . . . 0.0 110.281 -179.746 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.642 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.45 142.49 19.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 117.719 0.76 . . . . 0.0 110.493 179.368 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.836 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.63 118.29 54.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 179.784 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -120.19 136.83 54.5 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.17 0.51 . . . . 0.0 111.533 -178.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.695 HG23 HD11 ' A' ' 42' ' ' LEU . 88.5 mt -109.95 140.03 30.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.095 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.8 t-20 -131.29 111.56 11.99 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.915 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -91.54 6.64 44.85 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.275 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 50.8 t0 -79.56 -17.99 52.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.921 0.391 . . . . 0.0 110.333 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -102.78 144.17 14.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.903 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.438 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 70.3 m -116.15 118.89 37.5 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.969 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.438 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 1.8 Cg_endo -80.84 137.88 40.98 Favored 'Cis proline' 0 C--N 1.348 0.519 0 C-N-CA 123.768 -1.347 . . . . 0.0 111.891 -0.178 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -42.95 140.61 1.33 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.068 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -132.46 167.06 20.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.213 0.53 . . . . 0.0 111.81 -179.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.836 HD21 HG12 ' A' ' 16' ' ' ILE . 5.2 tt -121.11 131.18 54.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.788 179.374 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 45.2 m -118.75 126.27 51.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.062 0.458 . . . . 0.0 112.047 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.493 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 62.2 t90 -100.43 128.14 46.57 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.814 178.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.452 ' HG2' HG22 ' A' ' 37' ' ' VAL . 0.0 OUTLIER -125.02 118.8 27.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.841 0.353 . . . . 0.0 111.062 -179.843 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.441 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 30.7 t -45.44 167.18 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.314 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.3 -42.78 53.95 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.491 0.662 . . . . 0.0 109.748 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -85.22 -17.83 35.88 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.91 -1.041 . . . . 0.0 111.109 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.74 33.9 12.25 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.359 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -98.83 -22.08 16.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.625 0.25 . . . . 0.0 111.568 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.12 144.11 40.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.989 0.423 . . . . 0.0 111.379 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.452 HG22 ' HG2' ' A' ' 30' ' ' ARG . 42.4 t -139.23 144.06 29.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.758 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.493 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 49.3 t60 -137.27 145.95 44.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.03 0.443 . . . . 0.0 111.415 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.2 m -128.77 137.87 51.78 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.797 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 88.5 t -135.98 140.86 43.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.997 0.427 . . . . 0.0 111.663 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.653 HG22 HG23 ' A' ' 44' ' ' THR . 1.7 p -83.25 117.36 28.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 177.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.941 HD13 HD13 ' A' ' 107' ' ' ILE . 85.8 mt -75.63 -34.27 60.55 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.162 -0.472 . . . . 0.0 112.187 -178.612 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.422 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 22.4 t -51.07 -24.62 4.07 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.031 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.653 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -85.81 -23.7 27.09 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.816 0.341 . . . . 0.0 111.142 -179.693 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.537 HG12 ' HA ' ' A' ' 42' ' ' LEU . 41.9 mm -47.27 101.5 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.314 -179.653 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.402 ' N ' ' O ' ' A' ' 63' ' ' ILE . 11.2 t70 -95.25 -20.7 18.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.444 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.523 ' HB2' HG13 ' A' ' 63' ' ' ILE . 46.1 mtmt -153.33 138.58 17.47 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.939 0.399 . . . . 0.0 111.286 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.612 HD21 ' HB3' ' A' ' 104' ' ' LEU . 34.1 mt -109.59 124.35 50.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.899 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.401 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 25.9 mt-30 -109.91 130.48 55.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.398 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.662 ' HB3' ' HE2' ' A' ' 101' ' ' LYS . . . -145.81 138.95 26.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.097 -179.714 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 70.0 p -75.76 133.66 73.03 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.549 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.39 149.94 78.2 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.593 2.196 . . . . 0.0 112.443 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.02 -41.68 97.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.142 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 87.3 p -59.29 -26.17 64.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.867 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.9 t -87.73 118.91 27.55 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.874 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -57.7 -18.45 20.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.389 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 30.3 mmtt -65.51 110.07 2.57 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.995 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.464 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 19.0 mmm -94.49 123.9 38.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.44 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 11.5 ttm -177.18 160.42 1.73 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.224 0.535 . . . . 0.0 111.994 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.3 tp -148.46 123.91 10.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.86 179.388 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.401 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 33.0 mtt180 -116.47 136.68 52.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.141 0.496 . . . . 0.0 112.039 -178.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.424 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -111.55 131.0 55.55 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.884 179.02 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.523 HG13 ' HB2' ' A' ' 47' ' ' LYS . 1.0 OUTLIER -109.07 122.14 63.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.128 -179.365 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.58 145.96 17.89 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.354 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.9 mttt -58.62 158.82 7.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.854 0.359 . . . . 0.0 110.959 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.69 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.1 p -121.55 -162.13 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.894 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.69 ' H ' HG22 ' A' ' 66' ' ' VAL . 5.3 m-20 -175.99 55.41 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.33 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -58.3 -21.55 49.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.279 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 35.6 m -59.58 -17.96 37.06 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.061 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -69.05 -38.75 79.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.043 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.3 mptt 59.62 92.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.819 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.423 ' O ' HG22 ' A' ' 80' ' ' VAL . 43.0 mmt180 -95.2 140.87 29.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.991 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 26.1 mmtp -87.6 145.64 26.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.986 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -93.43 172.51 8.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.887 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -60.07 -19.98 55.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.328 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 51.2 mp0 -86.41 4.63 38.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.422 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.62 14.36 82.52 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.699 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -110.45 144.73 38.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.912 0.387 . . . . 0.0 110.948 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -70.96 148.97 47.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.105 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.462 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.1 m -132.21 158.83 43.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.932 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.5 t -102.66 98.62 11.43 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.671 178.735 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.462 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 85.0 Cg_exo -45.61 161.66 0.12 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.428 2.085 . . . . 0.0 112.546 -179.095 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -115.0 150.47 44.25 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.054 0.454 . . . . 0.0 110.978 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -72.56 147.41 45.87 Favored 'Trans proline' 0 N--CA 1.465 -0.164 0 C-N-CA 123.466 2.777 . . . . 0.0 112.728 -179.002 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -72.5 142.36 48.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.796 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.403 ' HG2' HG23 ' A' ' 63' ' ' ILE . 87.0 mtt180 -150.68 119.95 6.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.853 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -105.7 159.06 16.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.671 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.0 ttt -131.74 121.43 24.2 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.929 0.395 . . . . 0.0 111.33 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.646 ' CE2' HD11 ' A' ' 16' ' ' ILE . 91.8 m-85 -128.67 154.0 46.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.505 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 33.1 t -126.68 134.13 50.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.951 0.405 . . . . 0.0 111.141 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.821 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 83.3 m-85 -120.37 162.07 20.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.48 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.464 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 8.9 m120 -109.43 -21.28 12.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.214 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.566 ' HB2' HG23 ' A' ' 96' ' ' VAL . 87.0 m-20 -116.51 112.6 21.61 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.658 179.753 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -48.06 -29.38 3.5 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.02 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.5 -48.92 63.16 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.119 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.566 HG23 ' HB2' ' A' ' 93' ' ' ASN . 52.6 t -58.79 -52.73 56.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.416 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.482 ' HB3' ' CG ' ' A' ' 91' ' ' PHE . 4.0 ptm -62.91 -32.11 73.32 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.868 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.464 ' O ' ' HB3' ' A' ' 102' ' ' MET . 12.0 m-20 -63.63 -34.2 77.32 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.182 179.284 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -72.05 -44.18 63.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.483 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.501 HD12 ' CG2' ' A' ' 16' ' ' ILE . 23.4 mm -60.14 -50.52 79.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.568 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.662 ' HE2' ' HB3' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -61.7 -30.92 71.06 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.939 179.855 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.464 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.1 OUTLIER -79.09 -43.72 23.55 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.506 179.83 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.497 HG21 HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -67.47 -42.69 82.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.849 -179.801 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.818 ' CD2' HD22 ' A' ' 42' ' ' LEU . 35.9 mt -61.7 -39.49 91.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.556 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.519 ' HA ' HD12 ' A' ' 108' ' ' ILE . 36.5 mt-30 -60.86 -32.26 71.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.686 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -68.56 -29.48 68.05 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.812 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.941 HD13 HD13 ' A' ' 42' ' ' LEU . 23.4 mt -77.25 -50.44 20.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.319 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.519 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.3 mt -56.58 -61.1 1.32 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.622 0 CA-C-O 121.749 0.785 . . . . 0.0 109.268 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.6 t -50.56 -28.83 9.37 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.394 -1.275 . . . . 0.0 110.574 179.141 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 2.2 mtt180 -65.66 -39.83 91.8 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.663 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -85.9 -30.05 23.16 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.592 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.453 ' HE3' HG22 ' A' ' 108' ' ' ILE . 1.6 mttt . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.465 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.0 m . . . . . 0 C--O 1.233 0.193 0 CA-C-O 120.843 0.354 . . . . 0.0 110.972 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.416 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 58.8 m80 -134.93 35.46 3.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.169 0.509 . . . . 0.0 110.927 -179.684 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.537 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 58.7 p -178.61 114.96 0.07 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.919 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.424 ' O ' ' C ' ' A' ' 6' ' ' ALA . . . -146.2 113.24 0.67 Allowed Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.946 -0.645 . . . . 0.0 111.978 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.549 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -32.71 121.13 0.34 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.741 0.305 . . . . 0.0 111.327 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.716 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -137.35 149.96 47.38 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -178.861 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.597 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.2 mp -98.14 124.31 51.14 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.306 0 CA-C-O 121.119 0.485 . . . . 0.0 110.408 179.189 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.502 ' CD1' ' CE2' ' A' ' 89' ' ' PHE . 14.7 t80 -115.85 130.6 56.9 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.069 179.617 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 58.27 33.71 23.4 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.824 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.1 mttm 75.64 1.34 3.57 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.084 -178.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.485 ' O ' HG23 ' A' ' 8' ' ' ILE . 31.3 t -100.8 149.76 6.04 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.728 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.597 ' HA ' HG13 ' A' ' 8' ' ' ILE . 66.7 p -88.25 145.94 25.6 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.548 -179.415 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.449 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -175.54 -179.24 45.95 Favored Glycine 0 N--CA 1.442 -0.93 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.668 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.549 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 8.0 mm -106.69 136.32 41.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 CA-C-O 120.792 0.329 . . . . 0.0 110.138 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.652 HG12 HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -106.63 117.81 53.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 178.939 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.483 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -124.18 125.5 44.55 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.239 0.542 . . . . 0.0 111.551 -178.076 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.439 ' CD1' HG22 ' A' ' 103' ' ' THR . 33.7 mt -94.55 139.97 17.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.809 -179.567 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -131.41 113.76 14.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.031 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -91.01 5.47 48.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.239 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -78.59 -17.96 55.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.937 0.399 . . . . 0.0 110.428 179.254 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.33 143.96 12.7 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.824 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.422 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 1.4 t -119.61 116.15 33.44 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.966 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.483 ' HB2' ' CB ' ' A' ' 43' ' ' SER . 72.1 Cg_endo -77.39 148.41 87.08 Favored 'Cis proline' 0 C--N 1.348 0.544 0 C-N-CA 123.258 -1.559 . . . . 0.0 112.29 -0.098 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.56 139.37 7.02 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.793 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -130.66 166.98 19.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.192 0.52 . . . . 0.0 111.577 -179.22 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.652 HD21 HG12 ' A' ' 16' ' ' ILE . 4.8 tt -121.16 128.61 52.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.824 179.473 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.7 m -116.08 127.2 54.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.065 0.46 . . . . 0.0 111.821 -179.087 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.496 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 55.3 t90 -100.45 125.15 46.71 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.108 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.834 ' HD2' HG22 ' A' ' 37' ' ' VAL . 14.6 tpt180 -120.92 116.65 25.53 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.589 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 26.3 t -44.54 156.8 0.07 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.675 0.274 . . . . 0.0 110.879 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.449 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -65.94 -39.42 90.48 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 121.586 0.708 . . . . 0.0 109.305 179.866 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -88.16 -20.01 26.18 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.603 -1.18 . . . . 0.0 111.091 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.58 33.48 11.41 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.483 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -97.59 -22.31 16.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.704 0.288 . . . . 0.0 111.525 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.94 145.01 43.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.208 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.834 HG22 ' HD2' ' A' ' 30' ' ' ARG . 38.8 t -139.14 140.0 38.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.185 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.502 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 12.5 t-80 -139.61 145.84 39.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.401 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 52.4 m -129.02 138.44 51.92 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.97 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 85.4 t -132.61 140.91 46.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 121.151 0.5 . . . . 0.0 111.846 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.566 HG22 HG23 ' A' ' 44' ' ' THR . 2.1 p -87.42 118.12 32.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.166 178.027 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.994 HD13 HD13 ' A' ' 107' ' ' ILE . 84.3 mt -74.92 -31.77 61.63 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -178.305 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.483 ' CB ' ' HB2' ' A' ' 24' ' ' PRO . 3.2 t -53.74 -24.66 15.62 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.566 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -92.0 -22.41 19.99 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.806 0.336 . . . . 0.0 111.13 -179.791 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.567 HD12 ' HB3' ' A' ' 62' ' ' LEU . 46.4 mm -56.2 91.91 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.11 0.481 . . . . 0.0 110.844 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -63.36 -29.55 70.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.394 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.635 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 0.3 OUTLIER -153.99 157.41 39.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.09 0.471 . . . . 0.0 111.587 -179.751 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.632 HD23 ' HG3' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -128.34 127.59 42.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.544 179.138 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.766 ' O ' HD23 ' A' ' 60' ' ' LEU . 96.7 mt-30 -115.99 141.27 48.34 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.006 0.432 . . . . 0.0 111.548 -179.102 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.497 ' HB2' HD21 ' A' ' 60' ' ' LEU . . . -148.12 135.36 20.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.699 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 68.7 p -75.79 131.49 76.48 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.823 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -69.25 160.66 48.97 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.527 2.152 . . . . 0.0 112.404 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.9 -40.56 73.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.159 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 86.0 p -62.75 -26.79 68.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.816 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 41.2 t -75.74 121.7 22.92 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.92 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -56.25 -18.69 11.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.273 179.047 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.04 154.48 35.65 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.717 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.461 ' HE2' ' O ' ' A' ' 91' ' ' PHE . 63.6 mtp -143.07 79.75 1.66 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.916 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.4 mpp? -155.24 169.1 24.97 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.049 0.452 . . . . 0.0 111.446 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.766 HD23 ' O ' ' A' ' 49' ' ' GLN . 0.2 OUTLIER -132.36 124.24 28.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.989 179.33 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.415 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 2.6 mmt180 -107.83 121.95 45.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.954 0.407 . . . . 0.0 111.846 -179.051 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.567 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -102.7 134.8 45.49 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.141 178.968 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.635 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.3 mm -99.95 150.13 5.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.532 -0.303 . . . . 0.0 111.069 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -115.62 134.28 11.42 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.206 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 25.7 mttt -53.78 139.52 32.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.852 0.358 . . . . 0.0 111.066 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.74 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.4 p -113.3 -161.92 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.956 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.74 ' H ' HG22 ' A' ' 66' ' ' VAL . 0.2 OUTLIER -176.97 67.79 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.141 179.923 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.633 ' OE2' HG11 ' A' ' 66' ' ' VAL . 50.8 mp0 -58.31 -20.87 46.46 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.426 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 27.0 t -58.97 -17.98 29.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.176 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 52.7 mmtt -62.41 -44.02 97.43 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.777 0.323 . . . . 0.0 111.142 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 60.38 92.99 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.774 -179.876 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 14.1 mtt-85 -106.55 150.6 25.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.989 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.9 mmtt -96.64 149.05 22.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.91 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -96.58 171.66 8.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.866 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -59.68 -20.19 54.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.283 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -86.76 5.96 33.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.389 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.12 15.92 81.06 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.573 -0.823 . . . . 0.0 112.638 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -111.91 145.26 39.85 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.9 0.381 . . . . 0.0 110.943 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -74.04 145.74 44.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.942 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.478 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.2 m -130.53 158.92 42.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.062 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 19.0 t -101.62 98.66 9.9 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.698 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.478 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 80.8 Cg_exo -44.59 145.41 2.69 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.369 2.046 . . . . 0.0 112.651 -179.083 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.449 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 13.1 mtmt -100.67 148.54 35.14 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.953 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 16.8 Cg_exo -72.41 150.52 52.34 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 123.425 2.75 . . . . 0.0 112.654 -178.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -70.89 153.93 42.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.839 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.6 mpp_? -156.5 119.99 4.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.844 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 62.1 m-70 -100.61 155.76 17.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.575 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 23.9 ttt -129.13 125.23 36.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.903 0.382 . . . . 0.0 111.249 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.502 ' CE2' ' CD1' ' A' ' 9' ' ' PHE . 91.9 m-85 -130.86 146.38 52.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.484 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 5.8 t -119.39 133.64 55.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.867 0.365 . . . . 0.0 110.983 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.716 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 2.5 m-85 -125.96 136.35 52.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.82 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 34.2 m-20 -97.1 22.2 8.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.791 0.329 . . . . 0.0 111.076 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -144.99 107.28 4.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.573 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -52.83 -28.82 24.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.071 0.463 . . . . 0.0 111.055 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -77.16 -54.9 5.93 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.303 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 53.4 t -53.87 -46.97 64.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.856 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.66 -35.6 80.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.29 179.514 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -65.86 -32.79 74.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.559 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -66.71 -41.05 88.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.117 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.553 HD12 ' CG2' ' A' ' 16' ' ' ILE . 22.6 mm -66.29 -48.75 80.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.518 179.44 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.601 ' HB2' HD11 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -66.56 -27.63 67.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.57 179.664 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 40.6 mtm -78.48 -39.08 39.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.616 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.439 HG22 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -80.62 -32.03 36.44 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.658 179.841 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.753 ' HA ' HD12 ' A' ' 107' ' ' ILE . 13.6 mt -65.99 -39.33 90.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.621 179.741 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.816 ' HA ' HD12 ' A' ' 108' ' ' ILE . 10.6 mt-30 -62.71 -26.83 68.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.883 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -70.33 -43.73 69.69 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.951 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.994 HD13 HD13 ' A' ' 42' ' ' LEU . 4.1 mt -61.86 -47.02 95.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.327 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.911 HG22 ' CD ' ' A' ' 112' ' ' LYS . 2.6 mt -57.43 -60.03 2.58 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.572 0 CA-C-O 121.838 0.828 . . . . 0.0 109.347 179.181 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.1 m -48.78 -28.92 3.99 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.088 -1.414 . . . . 0.0 111.266 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.47 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 35.3 mtt-85 -69.26 -32.54 71.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.044 0.45 . . . . 0.0 110.809 179.686 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -90.01 -28.8 18.85 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.926 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.911 ' CD ' HG22 ' A' ' 108' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.336 0 CA-C-O 120.881 0.372 . . . . 0.0 110.543 179.568 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.2 t . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.851 0.358 . . . . 0.0 111.049 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 61.4 m80 64.42 32.5 11.89 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.172 0.511 . . . . 0.0 110.989 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.557 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 77.4 p 177.6 161.73 0.52 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.594 179.237 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.522 ' CA ' HG13 ' A' ' 96' ' ' VAL . . . 162.78 116.19 0.37 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.296 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.65 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -46.64 103.6 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.192 0.52 . . . . 0.0 111.431 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.833 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -118.87 152.23 36.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.769 -178.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.641 HG23 ' O ' ' A' ' 12' ' ' VAL . 1.0 OUTLIER -99.55 125.25 53.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.072 0.463 . . . . 0.0 110.419 179.009 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.507 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 10.0 t80 -113.34 130.12 56.36 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.132 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 82.5 mt-10 56.85 34.77 25.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.933 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.2 mttm 76.02 1.2 3.44 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.406 -179.163 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.641 ' O ' HG23 ' A' ' 8' ' ' ILE . 41.5 t -100.31 156.18 4.19 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.617 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.57 ' HA ' HG13 ' A' ' 8' ' ' ILE . 94.1 p -98.19 149.0 23.02 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 121.427 0.632 . . . . 0.0 112.588 -178.698 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.476 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.16 -179.74 46.24 Favored Glycine 0 N--CA 1.449 -0.493 0 CA-C-N 114.653 -1.158 . . . . 0.0 110.313 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.65 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.59 141.54 21.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 117.615 0.707 . . . . 0.0 110.406 179.344 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.846 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.63 118.45 54.37 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.737 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 179.565 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.486 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -120.99 131.19 54.15 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.17 0.51 . . . . 0.0 111.546 -178.467 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.77 HG23 HD11 ' A' ' 42' ' ' LEU . 90.3 mt -106.08 138.57 30.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.056 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -131.32 117.18 18.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.149 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -93.63 4.93 53.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.189 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -79.12 -17.59 54.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.959 0.409 . . . . 0.0 110.318 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.22 141.22 17.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.873 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.484 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.0 t -114.28 116.33 44.33 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.825 179.893 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.484 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 1.2 Cg_endo -81.43 142.95 56.86 Favored 'Cis proline' 0 C--N 1.349 0.589 0 C-N-CA 123.807 -1.33 . . . . 0.0 111.934 0.102 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -45.33 141.64 2.47 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.142 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -136.59 167.15 21.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.158 0.504 . . . . 0.0 111.626 -179.335 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.846 HD21 HG12 ' A' ' 16' ' ' ILE . 5.1 tt -121.19 129.2 53.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.818 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.7 m -117.43 126.21 52.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.159 0.504 . . . . 0.0 112.177 -178.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.479 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 59.8 t90 -100.51 128.88 46.44 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.937 179.008 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 26.3 ttt180 -124.58 116.78 22.99 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.81 0.338 . . . . 0.0 111.069 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.476 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 16.3 m -46.11 168.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.125 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -42.07 61.72 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 121.48 0.657 . . . . 0.0 109.555 179.526 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -85.22 -20.19 30.52 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.832 -1.076 . . . . 0.0 111.03 179.721 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.01 33.26 11.09 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.513 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 51.9 t0 -100.55 -23.1 14.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.655 0.264 . . . . 0.0 111.425 -179.781 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.427 ' CE ' HG21 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -129.88 135.67 48.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.995 -179.947 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 12.7 p -139.12 130.32 34.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.143 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.507 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 15.8 t-80 -129.43 145.79 51.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.022 0.439 . . . . 0.0 111.291 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 46.1 m -129.07 135.05 48.39 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.965 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 98.7 t -126.26 140.87 47.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.161 0.505 . . . . 0.0 111.513 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.577 HG22 HG23 ' A' ' 44' ' ' THR . 2.1 p -85.51 117.55 30.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.113 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 1.058 HD13 HD13 ' A' ' 107' ' ' ILE . 72.5 mt -75.37 -29.66 59.96 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.995 -178.532 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.448 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 9.7 t -56.14 -21.71 24.22 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.225 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.577 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -96.8 -21.89 17.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.699 0.285 . . . . 0.0 111.186 -179.794 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.761 HD12 ' HB3' ' A' ' 62' ' ' LEU . 38.0 mm -56.64 90.59 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.049 0.452 . . . . 0.0 110.89 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -71.06 -27.25 63.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.604 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.74 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 20.7 mttm -144.74 152.39 40.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.013 0.435 . . . . 0.0 111.629 -179.399 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.621 HD23 ' HG2' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -132.69 131.13 40.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.988 179.345 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.403 ' O ' HD23 ' A' ' 60' ' ' LEU . 94.1 mt-30 -125.9 143.78 50.94 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.95 -179.452 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.603 ' HB1' ' CE ' ' A' ' 97' ' ' MET . . . -145.26 145.94 31.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.979 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 42.5 p -75.7 128.26 84.06 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.505 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -61.41 154.16 60.91 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.573 2.182 . . . . 0.0 112.467 -179.619 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.87 -40.51 97.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.173 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 85.3 p -59.44 -26.8 65.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.859 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 29.5 m -86.32 117.37 25.08 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.843 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -56.38 -18.65 11.67 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.596 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.8 mmtm -71.83 124.0 23.88 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.029 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 27.3 mmm -104.15 118.9 37.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.498 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.4 ttm -175.75 161.62 2.58 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.176 0.512 . . . . 0.0 112.006 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.403 HD23 ' O ' ' A' ' 49' ' ' GLN . 1.4 tt -153.59 123.94 7.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.756 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 29.8 ttp180 -117.94 138.03 52.44 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.761 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -112.44 136.17 52.26 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.259 179.291 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.74 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.3 mm -103.29 133.79 46.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.816 0.341 . . . . 0.0 111.142 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -101.93 134.07 11.61 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.076 179.437 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 40.1 mttt -44.1 137.5 3.35 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.942 0.401 . . . . 0.0 111.286 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.722 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.2 p -105.2 -162.13 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.009 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.722 ' H ' HG22 ' A' ' 66' ' ' VAL . 52.1 t0 -173.55 68.99 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.261 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -56.0 -22.21 25.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.398 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.4 m -58.2 -18.87 29.04 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.907 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.7 mtmt -69.57 -42.62 74.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.981 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.7 mttt 60.26 92.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.866 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -92.03 137.9 31.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.873 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 28.8 mmtm -89.16 145.29 25.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.897 0.38 . . . . 0.0 110.893 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -93.29 171.95 8.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.883 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 40.7 t-20 -59.43 -20.53 55.74 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.301 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 50.7 mp0 -86.41 3.44 43.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.359 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.07 14.29 82.05 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.709 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -110.08 144.43 38.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.909 0.385 . . . . 0.0 110.969 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -70.73 147.26 49.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.094 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.432 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.8 m -140.48 158.65 24.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.028 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 20.3 t -83.64 110.19 23.23 Favored Pre-proline 0 C--N 1.326 -0.444 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.403 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.432 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 86.1 Cg_exo -46.2 145.26 5.7 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.196 1.931 . . . . 0.0 112.622 -178.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.519 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 8.5 mmtm -83.09 99.3 0.64 Allowed Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.126 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.519 ' HD2' ' HA ' ' A' ' 83' ' ' LYS . 1.3 Cg_endo -40.77 149.61 0.16 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 123.433 2.755 . . . . 0.0 112.598 179.165 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -65.38 139.64 58.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.776 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 12.0 mtp180 -150.5 120.02 6.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.868 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -103.48 143.49 32.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.579 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 23.7 ttt -118.55 131.91 56.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.231 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.57 ' CE1' HD11 ' A' ' 16' ' ' ILE . 94.1 m-85 -139.2 144.39 38.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.645 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 1.5 m -125.17 135.1 52.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.074 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.833 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 2.1 m-85 -123.22 172.5 8.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.532 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 69.9 m-20 -126.74 26.9 6.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.005 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -157.3 121.77 4.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.607 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 32.9 mmt-85 -56.1 -36.18 67.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.026 0.441 . . . . 0.0 110.76 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.14 -55.17 15.32 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.919 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.522 HG13 ' CA ' ' A' ' 5' ' ' GLY . 55.3 t -61.13 -40.75 86.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.105 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.603 ' CE ' ' HB1' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -69.31 -34.78 75.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.312 179.628 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.47 ' O ' ' HG2' ' A' ' 101' ' ' LYS . 67.3 m-20 -76.14 -31.02 58.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.08 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -62.23 -36.27 81.46 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.313 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.519 HD12 ' CG2' ' A' ' 16' ' ' ILE . 22.1 mm -70.57 -49.15 54.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.957 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.555 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 4.4 pttt -64.8 -27.51 68.93 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.923 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.456 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.1 OUTLIER -78.55 -41.91 30.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.109 179.564 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.488 HG21 HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -71.4 -41.4 69.66 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.641 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.682 ' HA ' HD12 ' A' ' 107' ' ' ILE . 13.9 mt -60.31 -41.1 92.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.801 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.761 ' HA ' HD12 ' A' ' 108' ' ' ILE . 1.5 mt-30 -61.87 -30.23 70.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.939 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -68.48 -36.27 78.7 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.118 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.058 HD13 HD13 ' A' ' 42' ' ' LEU . 6.6 mt -70.72 -46.65 68.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.476 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.87 HG22 ' HD3' ' A' ' 112' ' ' LYS . 2.5 mt -57.48 -61.09 1.42 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 CA-C-O 121.803 0.811 . . . . 0.0 109.385 179.157 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.4 p -50.28 -31.71 14.98 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.199 -1.364 . . . . 0.0 110.91 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 52.5 mtt-85 -68.63 -33.53 74.17 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.832 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.508 ' CE2' HG22 ' A' ' 107' ' ' ILE . 20.1 m-85 -92.19 -33.92 14.51 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.921 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.87 ' HD3' HG22 ' A' ' 108' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.788 179.784 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.0 m . . . . . 0 C--O 1.23 0.031 0 CA-C-O 120.854 0.359 . . . . 0.0 110.951 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 64.2 m80 -126.43 33.27 5.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.15 0.5 . . . . 0.0 110.924 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.539 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 62.9 p 179.14 115.73 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.889 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.425 ' O ' ' C ' ' A' ' 6' ' ' ALA . . . -146.64 113.45 0.67 Allowed Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.929 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.552 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -32.93 120.09 0.34 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.769 0.319 . . . . 0.0 111.269 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.538 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -136.28 151.32 49.52 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -178.767 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.593 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.2 mp -98.54 125.36 51.92 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.27 0 CA-C-O 121.063 0.458 . . . . 0.0 110.523 179.29 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.504 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 7.4 t80 -117.05 130.13 56.47 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.015 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 58.58 33.81 23.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.814 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 69.8 mttt 75.46 1.6 3.66 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.149 -178.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.467 ' O ' HG23 ' A' ' 8' ' ' ILE . 31.3 t -101.44 148.4 7.34 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.745 0 CA-C-N 116.031 -0.532 . . . . 0.0 109.63 179.055 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.593 ' HA ' HG13 ' A' ' 8' ' ' ILE . 78.7 p -86.83 146.21 26.3 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-O 121.446 0.641 . . . . 0.0 111.523 -179.368 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.444 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . -175.6 -179.1 45.92 Favored Glycine 0 N--CA 1.441 -0.984 0 CA-C-N 115.056 -0.975 . . . . 0.0 111.764 -179.528 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.552 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 7.0 mm -106.21 136.01 42.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 120.849 0.357 . . . . 0.0 110.062 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.695 HG12 HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -106.6 117.85 53.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.836 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.475 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -123.61 132.13 53.79 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.337 0.589 . . . . 0.0 111.596 -178.049 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.469 HD13 HG22 ' A' ' 103' ' ' THR . 46.1 mt -102.46 133.0 47.36 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.058 -179.409 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -124.35 114.18 19.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.012 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -88.35 5.61 41.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.251 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -78.37 -18.23 55.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.911 0.386 . . . . 0.0 110.358 179.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -98.07 145.43 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.904 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.413 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 1.2 t -121.81 116.25 30.37 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.991 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.489 ' HG2' HG23 ' A' ' 41' ' ' VAL . 72.1 Cg_endo -76.22 149.79 92.35 Favored 'Cis proline' 0 C--N 1.35 0.612 0 C-N-CA 123.211 -1.579 . . . . 0.0 112.108 -0.043 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.14 137.56 5.96 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.801 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -128.35 164.18 23.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.148 0.499 . . . . 0.0 111.803 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.695 HD21 HG12 ' A' ' 16' ' ' ILE . 4.8 tt -121.12 129.19 53.18 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.696 179.262 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.0 m -116.5 129.0 55.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.137 0.494 . . . . 0.0 111.902 -179.043 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.499 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 57.8 t90 -100.37 125.68 46.66 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.139 179.083 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.19 116.51 23.52 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.638 179.731 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.403 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 11.2 m -44.42 158.36 0.05 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.704 0.288 . . . . 0.0 110.975 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.425 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -66.34 -39.45 89.22 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.494 0.664 . . . . 0.0 109.263 179.974 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 48.0 p30 -85.51 -20.8 29.13 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.213 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.77 32.71 12.4 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.649 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -99.5 -23.56 15.06 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.839 0.352 . . . . 0.0 111.467 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.3 mtmt -130.12 142.42 50.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.07 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 14.4 p -139.04 136.71 42.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.22 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.504 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 35.2 t-80 -136.39 146.34 46.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.007 0.432 . . . . 0.0 111.347 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 43.5 m -127.47 136.95 52.5 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.951 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 92.6 t -132.38 140.87 46.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-O 121.018 0.437 . . . . 0.0 111.599 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.682 HG13 ' CG2' ' A' ' 44' ' ' THR . 0.8 OUTLIER -87.75 118.15 32.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 178.026 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 1.043 HD13 HD13 ' A' ' 107' ' ' ILE . 46.6 mt -71.61 -29.7 64.97 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -178.235 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.455 ' CB ' ' HB2' ' A' ' 24' ' ' PRO . 1.5 t -55.51 -22.22 20.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.671 0.272 . . . . 0.0 111.684 -179.39 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.682 ' CG2' HG13 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -88.69 -24.96 22.6 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.786 0.327 . . . . 0.0 111.252 -179.653 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.79 HD12 ' HB3' ' A' ' 62' ' ' LEU . 50.5 mm -56.04 91.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.064 0.459 . . . . 0.0 111.021 -179.745 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 63' ' ' ILE . 7.1 t0 -78.59 -25.82 45.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.598 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.408 ' HB2' HG13 ' A' ' 63' ' ' ILE . 7.2 mmmt -148.32 148.59 30.58 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.053 0.454 . . . . 0.0 111.518 -179.558 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.775 HD11 ' HB3' ' A' ' 104' ' ' LEU . 41.2 mt -115.68 124.37 50.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.498 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -115.15 137.84 51.57 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.76 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.739 ' HB2' ' CD1' ' A' ' 60' ' ' LEU . . . -145.89 151.27 37.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.014 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 55.1 p -75.72 130.31 79.3 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.58 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.32 158.46 44.64 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.583 2.189 . . . . 0.0 112.489 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.59 -43.0 97.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.066 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.1 m -59.35 -27.59 66.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.072 0.463 . . . . 0.0 110.822 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 31.5 t -82.31 119.55 24.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.896 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -57.18 -18.27 14.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.44 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 35.8 mmtm -60.45 155.85 17.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.854 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 17.3 mtp -143.02 79.9 1.66 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.794 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -147.55 167.22 25.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.061 0.458 . . . . 0.0 111.63 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.739 ' CD1' ' HB2' ' A' ' 50' ' ' ALA . 13.2 tp -136.46 128.66 29.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.034 179.458 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -114.26 122.03 45.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.945 0.402 . . . . 0.0 111.788 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.79 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.3 OUTLIER -97.24 139.6 32.97 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.924 179.014 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.507 HD13 ' HG2' ' A' ' 86' ' ' ARG . 0.9 OUTLIER -115.66 119.22 61.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.017 -179.686 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -89.49 151.77 22.13 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.248 179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.8 mttm -59.06 135.51 57.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.805 0.336 . . . . 0.0 110.762 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.786 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.3 p -79.62 -167.55 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.169 0.509 . . . . 0.0 111.193 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.786 ' H ' HG22 ' A' ' 66' ' ' VAL . 54.2 p-10 -148.44 59.51 1.08 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.638 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -56.01 -22.55 27.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.387 -179.553 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.4 t -59.62 -17.52 34.07 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.015 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.8 mmtp -71.01 -50.68 31.51 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.761 0.315 . . . . 0.0 111.092 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.4 mmtm 63.43 95.22 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.712 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 31.6 mmt180 -99.65 168.64 9.8 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.804 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 7.9 mttt -124.91 146.69 49.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.96 0.409 . . . . 0.0 111.08 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -86.28 171.93 10.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.8 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -62.15 -18.11 59.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.343 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -85.95 4.38 37.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.569 0.223 . . . . 0.0 111.425 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 83.54 3.22 89.87 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.78 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.402 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 24.2 p30 -91.26 168.14 11.81 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.738 0.304 . . . . 0.0 110.763 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -94.89 153.38 17.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.851 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.44 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.2 m -138.18 158.9 32.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.969 0.414 . . . . 0.0 111.222 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 38.5 t -101.93 98.74 10.52 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.563 178.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.44 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 93.5 Cg_exo -42.81 145.34 1.12 Allowed 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.537 2.158 . . . . 0.0 112.779 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.449 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 11.4 mttp -84.35 148.58 53.01 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.054 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.578 ' HA ' HG23 ' A' ' 66' ' ' VAL . 16.4 Cg_exo -73.06 162.4 40.96 Favored 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 123.509 2.806 . . . . 0.0 112.741 -178.95 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -65.45 144.03 57.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.802 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.507 ' HG2' HD13 ' A' ' 63' ' ' ILE . 32.9 mtp180 -145.12 119.92 9.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.935 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 58.2 m-70 -107.4 159.11 16.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.61 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.1 ttt -130.44 132.03 45.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.029 0.442 . . . . 0.0 111.345 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.663 ' CE2' HD11 ' A' ' 16' ' ' ILE . 87.6 m-85 -138.62 145.99 41.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.459 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -118.96 133.87 55.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.809 0.338 . . . . 0.0 111.1 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.502 ' N ' ' CD1' ' A' ' 91' ' ' PHE . 1.4 m-85 -127.5 158.24 37.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.573 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 53.5 m-20 -115.79 25.53 10.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.936 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.478 ' HB3' HG23 ' A' ' 96' ' ' VAL . 47.3 t-20 -156.68 108.03 2.42 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.487 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 8.9 tpp180 -46.86 -29.87 2.21 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.005 0.431 . . . . 0.0 111.288 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.2 -54.0 9.54 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.537 -179.738 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.478 HG23 ' HB3' ' A' ' 93' ' ' ASN . 58.1 t -53.63 -49.66 54.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.827 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.432 ' HB3' ' CG ' ' A' ' 91' ' ' PHE . 18.7 ptm -63.98 -37.22 86.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.0 0.429 . . . . 0.0 110.064 179.386 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -66.38 -31.2 71.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.511 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -67.89 -40.46 83.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.931 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.67 HG22 HD12 ' A' ' 104' ' ' LEU . 24.7 mm -66.43 -49.77 72.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.423 179.273 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 3.9 pttt -66.01 -27.28 68.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.46 179.525 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 64.6 mtp -78.25 -40.19 37.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.542 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.469 HG22 HD13 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -79.11 -37.18 39.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.514 179.735 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.807 ' HA ' HD12 ' A' ' 107' ' ' ILE . 12.0 mt -61.59 -39.56 91.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.767 179.711 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.756 ' HA ' HD12 ' A' ' 108' ' ' ILE . 1.0 OUTLIER -61.65 -29.1 69.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.878 179.874 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 99.6 mm-40 -69.23 -33.8 73.83 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.811 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.043 HD13 HD13 ' A' ' 42' ' ' LEU . 4.0 mt -72.52 -44.48 61.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.308 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.87 HG22 ' HD3' ' A' ' 112' ' ' LYS . 2.6 mt -58.84 -61.18 1.52 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.551 0 CA-C-O 121.764 0.792 . . . . 0.0 109.474 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.1 t -50.91 -28.84 10.51 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.16 -1.382 . . . . 0.0 110.943 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 49.3 mtt180 -70.32 -33.7 71.82 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.762 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.477 ' CE2' HG22 ' A' ' 107' ' ' ILE . 19.9 m-85 -92.32 -35.33 13.8 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.938 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.87 ' HD3' HG22 ' A' ' 108' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.741 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.2 t . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.664 0.269 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.449 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 55.1 m80 -117.37 37.9 3.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.982 0.42 . . . . 0.0 111.265 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.521 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 1.2 m -166.68 176.62 7.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.671 179.258 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 159.08 126.09 0.84 Allowed Glycine 0 N--CA 1.444 -0.814 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.321 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.606 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -53.65 111.65 0.77 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.018 0.437 . . . . 0.0 111.192 -179.689 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.631 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -125.81 150.27 47.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.831 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.551 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -100.14 125.78 53.8 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.267 0 CA-C-O 120.979 0.418 . . . . 0.0 110.222 179.049 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.507 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 6.1 t80 -112.93 131.16 55.85 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.284 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.0 mt-10 55.07 34.25 22.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.859 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.0 mttp 76.44 0.8 3.26 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.365 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.527 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.4 t -98.78 154.25 4.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 178.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.551 ' HA ' HG13 ' A' ' 8' ' ' ILE . 83.6 p -96.32 149.0 22.17 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 121.721 0.772 . . . . 0.0 112.742 -178.421 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.469 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.7 -179.69 46.72 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 114.449 -1.25 . . . . 0.0 110.292 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.606 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.71 144.35 15.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 117.673 0.736 . . . . 0.0 110.529 179.36 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.825 HG12 HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -106.81 118.55 54.77 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 CA-C-N 115.358 -0.837 . . . . 0.0 108.835 179.577 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.521 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -121.14 132.31 54.78 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.355 -178.689 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.514 ' CG1' HD12 ' A' ' 27' ' ' LEU . 59.3 mt -104.08 140.1 23.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.074 -179.163 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -132.51 111.46 11.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.862 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -90.36 5.2 48.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.325 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -78.9 -17.76 55.02 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.954 0.406 . . . . 0.0 110.36 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.62 142.97 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.947 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.426 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.5 t -115.81 116.77 40.47 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.834 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.426 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 2.1 Cg_endo -80.08 144.65 69.92 Favored 'Cis proline' 0 C--N 1.348 0.534 0 C-N-CA 123.707 -1.372 . . . . 0.0 111.933 0.142 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.78 139.58 5.25 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.886 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -133.49 167.27 20.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.088 0.47 . . . . 0.0 111.661 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.825 HD21 HG12 ' A' ' 16' ' ' ILE . 5.6 tt -120.97 128.78 53.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.639 179.348 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.3 m -114.74 127.48 55.77 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.208 0.528 . . . . 0.0 112.085 -178.788 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.496 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 56.3 t90 -100.43 128.8 46.39 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.8 179.029 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 14.6 tpt180 -123.51 116.04 22.52 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.79 0.329 . . . . 0.0 110.976 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.469 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 30.9 t -45.37 164.36 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.062 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.41 -41.56 66.12 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.482 0.658 . . . . 0.0 109.507 179.653 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -82.32 -22.17 35.72 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.792 -1.094 . . . . 0.0 111.027 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.72 32.99 10.42 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.458 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -106.82 -20.18 13.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.712 0.291 . . . . 0.0 111.433 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.487 ' HE2' HG21 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -129.46 135.0 48.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.799 0.333 . . . . 0.0 111.109 -179.814 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 13.2 p -139.15 138.93 40.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.042 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.507 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 34.7 t-80 -136.81 146.24 45.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.082 0.468 . . . . 0.0 111.364 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 48.2 m -127.15 132.77 50.46 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.073 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 95.7 t -124.32 140.87 46.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.457 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.61 HG22 HG23 ' A' ' 44' ' ' THR . 2.1 p -85.2 117.33 30.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 178.1 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 1.031 HD13 HD13 ' A' ' 107' ' ' ILE . 68.5 mt -75.7 -30.42 59.33 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.124 -178.538 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.409 ' HB3' ' HB3' ' A' ' 24' ' ' PRO . 60.5 p -56.12 -21.74 24.2 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -179.004 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.61 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -93.91 -24.73 17.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.742 0.306 . . . . 0.0 111.287 -179.704 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.829 HD12 ' HB3' ' A' ' 62' ' ' LEU . 42.7 mm -51.17 93.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.983 0.421 . . . . 0.0 110.918 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -77.54 -27.68 51.7 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.511 -179.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.61 ' CE ' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -140.3 159.15 42.83 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 121.201 0.524 . . . . 0.0 111.381 -179.298 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.748 HD11 ' HB3' ' A' ' 104' ' ' LEU . 27.4 mt -126.89 124.24 39.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.953 178.683 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.432 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 79.9 mt-30 -120.81 136.9 54.78 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.977 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.402 ' HB2' ' HG ' ' A' ' 60' ' ' LEU . . . -148.23 151.23 35.12 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.115 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 60.5 p -75.56 126.82 87.01 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.44 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -59.51 155.85 39.61 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.55 2.167 . . . . 0.0 112.515 -179.731 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.48 -43.08 97.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.091 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 93.6 p -59.59 -27.62 66.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.038 0.447 . . . . 0.0 110.722 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 26.3 t -80.62 120.9 25.16 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.954 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -56.65 -18.48 12.35 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.334 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 30.4 mmtt -66.79 156.49 35.38 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.872 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.496 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 31.7 mtp -143.0 89.89 2.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.743 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.466 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 44.3 mtm -155.74 156.36 34.72 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.052 0.453 . . . . 0.0 111.817 -179.65 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.553 HD11 ' HD2' ' A' ' 101' ' ' LYS . 0.1 OUTLIER -131.61 123.9 28.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.38 179.707 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.432 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 39.0 mtp180 -107.82 127.08 53.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.847 0.355 . . . . 0.0 111.333 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.829 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -111.04 123.45 50.22 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.943 -179.929 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.61 HD13 ' CE ' ' A' ' 47' ' ' LYS . 3.9 mp -109.64 136.04 46.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.831 0.348 . . . . 0.0 111.136 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.9 -169.42 38.21 Favored Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.378 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.91 143.43 34.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.759 0.314 . . . . 0.0 110.807 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.747 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.3 p -99.97 -162.25 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.045 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.747 ' H ' HG22 ' A' ' 66' ' ' VAL . 14.3 t70 -175.14 70.97 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.254 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.558 ' OE1' HG12 ' A' ' 81' ' ' VAL . 52.7 mm-40 -56.9 -20.61 24.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.492 -179.486 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 27.1 t -57.51 -18.59 19.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.206 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.3 mmmt -57.76 -46.77 84.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.068 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? 62.29 94.32 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.856 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 57.7 mmm-85 -107.64 154.92 20.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.822 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -119.11 145.33 46.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.908 0.385 . . . . 0.0 111.041 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -84.85 171.27 12.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.865 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -61.97 -18.09 59.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.384 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -85.41 4.67 34.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.551 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 81.61 6.57 89.02 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.722 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -94.23 162.07 14.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.707 0.289 . . . . 0.0 110.681 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -94.97 151.83 18.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.938 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.459 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.3 m -135.41 158.93 40.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.15 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.558 HG12 ' OE1' ' A' ' 68' ' ' GLU . 19.4 t -101.05 98.73 9.13 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.708 178.774 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.459 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 92.1 Cg_exo -42.81 145.52 1.07 Allowed 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.562 2.175 . . . . 0.0 112.845 -179.005 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.411 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 2.6 tttt -104.48 150.84 38.93 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.715 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 16.9 Cg_exo -72.43 147.14 46.09 Favored 'Trans proline' 0 N--CA 1.464 -0.207 0 C-N-CA 123.524 2.816 . . . . 0.0 112.699 -178.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -65.63 133.73 51.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.905 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.52 ' HG2' ' CG1' ' A' ' 63' ' ' ILE . 10.4 mtm180 -123.94 124.43 42.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.767 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -93.49 159.15 15.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.554 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 25.4 ttt -133.45 128.99 36.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.87 0.367 . . . . 0.0 111.381 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.623 ' CE1' HD11 ' A' ' 16' ' ' ILE . 97.9 m-85 -139.68 148.99 43.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.603 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.466 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 2.8 t -125.64 124.17 40.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.841 0.353 . . . . 0.0 110.937 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.631 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 3.8 m-85 -112.44 170.61 8.05 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.914 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.496 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 27.7 p30 -128.76 26.09 5.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.146 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.459 ' ND2' ' O ' ' A' ' 92' ' ' ASN . 26.0 m120 -153.53 112.05 3.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.65 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.71 -33.0 63.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.208 0.528 . . . . 0.0 110.902 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.19 -49.64 54.81 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.162 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.4 HG23 ' CB ' ' A' ' 93' ' ' ASN . 47.9 t -58.89 -40.64 80.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.556 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.438 ' SD ' HD12 ' A' ' 60' ' ' LEU . 0.6 OUTLIER -63.48 -33.56 75.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.431 179.508 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -65.44 -35.4 80.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.741 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -69.28 -41.19 77.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.806 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.445 HG22 HD12 ' A' ' 104' ' ' LEU . 21.5 mm -62.76 -52.02 64.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.738 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.553 ' HD2' HD11 ' A' ' 60' ' ' LEU . 5.6 mtpp -64.55 -27.87 69.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.723 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 36.3 mtm -78.42 -36.88 45.06 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.062 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.512 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.5 OUTLIER -82.06 -38.96 24.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.009 -179.792 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.836 ' CD2' HD22 ' A' ' 42' ' ' LEU . 16.2 mt -64.08 -39.67 94.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.841 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.711 ' HA ' HD12 ' A' ' 108' ' ' ILE . 2.3 mt-30 -64.46 -29.34 70.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.865 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -69.37 -31.64 70.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.921 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.031 HD13 HD13 ' A' ' 42' ' ' LEU . 5.9 mt -74.89 -46.43 40.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.282 -179.87 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.711 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.2 mt -58.22 -61.24 1.44 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.589 0 CA-C-O 121.689 0.757 . . . . 0.0 109.343 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.5 m -50.53 -28.91 9.39 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.325 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.92 -41.56 97.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.449 179.392 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 75.5 m-85 -83.64 -29.65 27.51 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.344 179.502 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.473 ' CE ' HG22 ' A' ' 108' ' ' ILE . 18.9 mttt . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.502 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.0 t . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.862 0.363 . . . . 0.0 110.932 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 52.8 m80 62.19 32.6 17.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.218 0.533 . . . . 0.0 110.876 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.589 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 75.1 p 178.11 162.41 0.63 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.572 179.177 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.419 ' CA ' HG13 ' A' ' 96' ' ' VAL . . . 161.6 116.27 0.39 Allowed Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.716 -0.755 . . . . 0.0 112.535 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.639 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -46.88 102.87 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.104 0.478 . . . . 0.0 111.298 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.823 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -117.64 151.79 36.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.931 -178.921 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.556 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.9 OUTLIER -98.78 123.88 51.65 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.26 0 CA-C-O 121.101 0.477 . . . . 0.0 110.373 178.918 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.504 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 14.3 t80 -112.26 130.17 56.02 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.045 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 56.52 34.35 24.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.731 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.8 mtpm? 75.88 1.7 3.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.287 -179.072 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.511 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.8 t -100.8 154.57 4.56 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.596 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.001 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.556 ' HA ' HG13 ' A' ' 8' ' ' ILE . 89.5 p -95.66 149.42 21.48 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 121.549 0.69 . . . . 0.0 112.646 -178.594 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.465 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 174.54 -179.73 45.68 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 114.645 -1.161 . . . . 0.0 110.41 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.639 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.83 141.91 20.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 117.795 0.797 . . . . 0.0 110.579 179.426 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.865 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.77 118.48 54.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 179.62 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.5 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -121.83 130.44 53.39 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.525 -178.496 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.862 HG23 HD11 ' A' ' 42' ' ' LEU . 77.2 mt -101.45 129.7 52.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.12 -179.526 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 51.6 t30 -116.1 111.44 20.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.034 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -89.75 7.03 38.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.165 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -78.94 -18.47 53.74 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.852 0.358 . . . . 0.0 110.384 179.369 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.502 ' CG2' ' N ' ' A' ' 23' ' ' SER . 0.5 OUTLIER -100.19 159.77 3.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.892 -179.961 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.502 ' N ' ' CG2' ' A' ' 22' ' ' VAL . 2.0 t -131.04 117.11 16.98 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.04 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.449 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 71.8 Cg_endo -77.12 147.48 85.89 Favored 'Cis proline' 0 C--N 1.349 0.581 0 C-N-CA 123.36 -1.517 . . . . 0.0 112.188 0.004 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.22 136.51 9.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.727 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -128.07 166.89 17.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.222 0.534 . . . . 0.0 111.673 -179.178 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.865 HD21 HG12 ' A' ' 16' ' ' ILE . 5.0 tt -121.27 132.97 55.12 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.852 179.411 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 49.8 m -119.68 126.95 52.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.155 0.502 . . . . 0.0 112.031 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.482 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 57.9 t90 -100.58 130.31 46.62 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.884 179.116 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 24.4 tpt85 -125.25 114.99 19.67 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.837 0.351 . . . . 0.0 110.725 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.465 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 72.5 p -45.47 165.37 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.06 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.59 -42.35 58.87 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.481 0.658 . . . . 0.0 109.795 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -78.55 -22.74 46.78 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.101 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.52 33.44 10.27 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.381 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -111.36 -18.67 12.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.56 0.219 . . . . 0.0 111.588 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.506 ' NZ ' HG21 ' A' ' 12' ' ' VAL . 6.3 mtmt -128.65 134.57 48.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.909 0.385 . . . . 0.0 111.187 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 11.0 p -139.26 141.83 34.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.038 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.504 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 23.8 t-80 -137.6 146.1 43.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.125 0.488 . . . . 0.0 111.286 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 37.2 m -127.74 135.11 49.7 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.97 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.6 t -130.72 140.86 47.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 121.008 0.432 . . . . 0.0 111.548 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.772 HG13 ' CG2' ' A' ' 44' ' ' THR . 1.3 p -86.37 118.11 32.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.178 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 1.013 HD13 HD13 ' A' ' 107' ' ' ILE . 63.9 mt -70.89 -31.2 67.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.239 -0.437 . . . . 0.0 112.159 -178.34 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.439 ' CB ' ' HB2' ' A' ' 24' ' ' PRO . 2.0 t -52.67 -23.79 7.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.759 0.314 . . . . 0.0 111.543 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.772 ' CG2' HG13 ' A' ' 41' ' ' VAL . 0.2 OUTLIER -86.25 -25.94 25.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.092 -179.866 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.527 HG12 ' HA ' ' A' ' 42' ' ' LEU . 41.6 mm -49.62 98.8 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.045 0.45 . . . . 0.0 111.116 -179.627 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -94.22 -21.01 19.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.583 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.408 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 61.2 mttm -156.61 137.68 13.61 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.976 0.417 . . . . 0.0 111.362 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.707 HD11 ' HB3' ' A' ' 104' ' ' LEU . 60.0 mt -109.37 124.26 50.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.595 179.431 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.408 ' HB3' ' HB3' ' A' ' 61' ' ' ARG . 4.8 tp60 -109.66 130.93 55.47 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.55 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.527 ' HB3' ' NZ ' ' A' ' 101' ' ' LYS . . . -141.87 140.79 32.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.192 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.465 HG23 ' O ' ' A' ' 59' ' ' MET . 71.3 p -75.7 124.0 88.59 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.523 179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -61.51 160.31 28.43 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.578 2.185 . . . . 0.0 112.598 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.58 -42.97 97.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.095 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 86.2 p -60.26 -27.66 67.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.041 0.448 . . . . 0.0 110.603 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 28.7 t -81.22 119.9 24.2 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.806 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.1 tp10 -55.88 -18.86 9.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.386 179.232 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.1 mmtt -60.42 151.62 27.65 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.895 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.462 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 45.6 mtp -143.14 89.46 2.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.606 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.886 ' HG3' ' HE2' ' A' ' 88' ' ' MET . 3.0 tmm? -172.85 147.22 1.67 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.001 0.429 . . . . 0.0 111.469 -179.558 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.741 HD11 ' HB2' ' A' ' 101' ' ' LYS . 0.4 OUTLIER -114.39 134.53 54.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.309 179.687 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.408 ' HB3' ' HB3' ' A' ' 49' ' ' GLN . 0.5 OUTLIER -120.82 124.22 44.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.036 0.446 . . . . 0.0 111.742 -179.519 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.5 HD11 HD23 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -94.89 144.14 25.9 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.433 179.386 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.558 HD13 ' HG2' ' A' ' 86' ' ' ARG . 1.2 mm -118.27 124.01 72.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.019 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -92.17 154.53 22.42 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.534 -0.841 . . . . 0.0 112.367 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 37.3 mttt -67.75 155.56 39.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.837 0.351 . . . . 0.0 110.851 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.72 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.3 p -121.16 -162.31 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.996 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.72 ' H ' HG22 ' A' ' 66' ' ' VAL . 40.6 t0 -177.67 71.11 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.234 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.672 ' HB3' HG23 ' A' ' 81' ' ' VAL . 82.0 mt-10 -55.13 -23.38 20.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.341 -179.391 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.9 m -62.93 -15.04 53.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.935 179.615 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.3 mmtt -66.81 -43.86 82.75 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.709 0.29 . . . . 0.0 111.038 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.4 mptt 60.67 93.09 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.781 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.434 ' HD2' HG22 ' A' ' 80' ' ' VAL . 0.0 OUTLIER -104.47 137.91 41.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.87 -179.812 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.9 mmtp -83.7 145.33 28.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.088 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.472 ' CG ' HG11 ' A' ' 80' ' ' VAL . 9.0 m-20 -88.02 176.82 7.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.975 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -67.01 -15.99 64.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.404 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -88.38 -7.9 55.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.242 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 94.37 9.27 59.25 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.626 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -103.29 145.7 29.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.791 0.329 . . . . 0.0 110.864 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -78.4 140.87 38.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.963 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.472 HG11 ' CG ' ' A' ' 74' ' ' ASP . 1.3 m -140.56 152.63 21.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.191 0.52 . . . . 0.0 111.387 -179.785 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.672 HG23 ' HB3' ' A' ' 68' ' ' GLU . 2.3 p -85.29 109.03 18.17 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.554 178.826 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.444 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 52.2 Cg_exo -53.22 145.55 43.4 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.128 1.885 . . . . 0.0 112.483 -178.941 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 2.9 mmpt? -89.97 154.52 47.52 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.997 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 19.2 Cg_exo -71.48 144.26 44.76 Favored 'Trans proline' 0 N--CA 1.465 -0.189 0 C-N-CA 123.514 2.81 . . . . 0.0 112.685 -178.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -66.43 141.93 57.76 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.97 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.558 ' HG2' HD13 ' A' ' 63' ' ' ILE . 16.9 mtm180 -144.78 120.0 10.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.651 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.422 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 68.3 m-70 -109.55 159.05 17.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.538 179.813 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.886 ' HE2' ' HG3' ' A' ' 59' ' ' MET . 13.7 ttt -133.62 139.96 46.82 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.076 0.465 . . . . 0.0 111.401 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.639 ' CE2' HD11 ' A' ' 16' ' ' ILE . 91.7 m-85 -148.71 125.35 11.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.146 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 27.0 t -101.63 134.52 44.64 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.967 0.413 . . . . 0.0 111.542 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.823 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 2.2 m-85 -123.37 130.3 52.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.583 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.462 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 12.9 m120 -74.3 -18.57 60.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.353 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.527 ' HB2' HG23 ' A' ' 96' ' ' VAL . 96.8 m-20 -114.51 114.36 25.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.827 0.346 . . . . 0.0 110.825 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.94 -26.64 26.46 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.057 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.14 -46.04 62.34 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.255 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.527 HG23 ' HB2' ' A' ' 93' ' ' ASN . 61.4 t -58.49 -52.36 60.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.622 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.458 ' HB3' ' CG ' ' A' ' 91' ' ' PHE . 9.8 ptm -60.24 -32.35 71.06 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.418 ' O ' ' HE2' ' A' ' 102' ' ' MET . 47.3 t0 -61.55 -35.02 76.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.388 179.397 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.437 ' O ' ' HB ' ' A' ' 103' ' ' THR . 25.6 m120 -71.66 -44.42 64.34 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.459 179.504 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.581 HG22 HD12 ' A' ' 104' ' ' LEU . 23.2 mm -60.53 -52.1 65.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.14 0.495 . . . . 0.0 110.679 179.437 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.741 ' HB2' HD11 ' A' ' 60' ' ' LEU . 1.3 ttmt -62.2 -30.88 71.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.799 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.418 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 41.8 mtm -78.56 -40.45 34.76 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.855 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.437 ' HB ' ' O ' ' A' ' 99' ' ' ASN . 0.6 OUTLIER -76.06 -42.99 45.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.874 -179.879 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.757 ' CD2' HD22 ' A' ' 42' ' ' LEU . 18.0 mt -60.73 -37.07 80.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.772 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.748 ' HA ' HD12 ' A' ' 108' ' ' ILE . 1.1 mm-40 -63.43 -29.75 70.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.836 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -67.4 -37.1 82.57 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.972 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.013 HD13 HD13 ' A' ' 42' ' ' LEU . 3.5 mt -68.51 -44.08 83.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.294 -179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.914 HG22 ' CD ' ' A' ' 112' ' ' LYS . 2.5 mt -60.83 -61.21 1.66 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.589 0 CA-C-O 121.847 0.832 . . . . 0.0 109.393 179.08 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 27.5 m -53.27 -28.85 29.9 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.172 -1.376 . . . . 0.0 110.853 179.369 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 51.4 mtt-85 -72.45 -33.74 67.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.666 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.452 ' CE2' ' CG2' ' A' ' 107' ' ' ILE . 22.3 m-30 -87.99 -31.12 19.52 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.842 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.914 ' CD ' HG22 ' A' ' 108' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.289 0 CA-C-O 121.045 0.45 . . . . 0.0 110.64 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.4 t . . . . . 0 CA--C 1.527 0.078 0 CA-C-O 120.866 0.365 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 78.0 m80 63.59 32.68 13.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.244 0.545 . . . . 0.0 111.039 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.653 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 80.6 p 178.47 172.99 0.7 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.688 178.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.412 ' CA ' ' CG1' ' A' ' 96' ' ' VAL . . . 153.17 117.2 0.67 Allowed Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.028 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.589 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -39.82 117.85 0.8 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.897 0.379 . . . . 0.0 111.224 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.654 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -134.47 152.03 51.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.738 -179.114 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.6 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.2 mp -98.39 126.69 51.41 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.263 0 CA-C-O 121.138 0.494 . . . . 0.0 110.78 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.507 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 9.5 t80 -118.82 128.66 54.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.724 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.439 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 82.4 mt-10 59.02 36.79 24.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.595 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.439 ' HB2' ' O ' ' A' ' 10' ' ' GLU . 1.6 mtmt 72.13 2.43 4.31 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.31 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.466 ' O ' ' N ' ' A' ' 9' ' ' PHE . 30.0 t -102.37 146.68 10.03 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.71 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.6 ' HA ' HG13 ' A' ' 8' ' ' ILE . 88.0 p -85.96 146.71 26.56 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.595 -179.294 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.46 ' O ' ' N ' ' A' ' 7' ' ' ALA . . . -177.33 -179.1 47.47 Favored Glycine 0 N--CA 1.442 -0.907 0 CA-C-N 115.168 -0.924 . . . . 0.0 111.758 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.589 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.0 mm -104.48 137.57 32.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-O 120.951 0.405 . . . . 0.0 110.229 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.781 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.73 118.22 54.05 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 178.758 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.562 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -125.63 124.44 41.19 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.162 0.506 . . . . 0.0 111.484 -178.01 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.535 ' CG1' HD12 ' A' ' 27' ' ' LEU . 76.5 mt -98.72 139.24 21.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.04 -179.444 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -130.93 112.31 12.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.954 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -86.62 0.63 54.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.341 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -76.57 -17.79 59.02 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 121.029 0.442 . . . . 0.0 110.283 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -95.99 134.86 32.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.858 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.404 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 1.0 OUTLIER -111.37 116.68 50.59 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.016 -179.971 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.44 ' HG2' HG23 ' A' ' 41' ' ' VAL . 95.7 Cg_endo -78.21 154.05 92.9 Favored 'Cis proline' 0 C--N 1.349 0.554 0 C-N-CA 123.387 -1.505 . . . . 0.0 112.125 0.003 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.423 ' HB1' HD12 ' A' ' 42' ' ' LEU . . . -49.3 138.34 12.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.891 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -134.26 162.54 31.9 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.174 0.512 . . . . 0.0 111.517 -179.307 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.781 HD21 HG12 ' A' ' 16' ' ' ILE . 5.8 tt -121.25 125.39 46.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.536 179.244 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.2 m -113.24 126.95 55.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.156 0.503 . . . . 0.0 112.295 -178.78 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.47 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 64.2 t90 -100.41 128.97 46.33 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.914 178.856 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.673 ' HG3' HG22 ' A' ' 37' ' ' VAL . 15.9 ttm105 -128.31 117.94 22.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.824 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.444 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 17.0 t -44.73 155.88 0.09 Allowed 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.768 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.447 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -65.06 -39.62 93.53 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.529 0.681 . . . . 0.0 109.349 -179.925 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -79.99 -25.32 40.35 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 114.634 -1.166 . . . . 0.0 111.132 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 90.97 31.65 9.71 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.662 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -101.9 -21.2 14.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.61 0.243 . . . . 0.0 111.442 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 11.8 mtmt -128.69 138.33 52.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.764 0.316 . . . . 0.0 111.141 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.673 HG22 ' HG3' ' A' ' 30' ' ' ARG . 47.4 t -139.09 132.85 39.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.032 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.507 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 26.8 t-80 -136.65 146.31 45.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.137 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 49.0 m -127.68 139.1 52.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.107 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 96.1 t -128.49 140.91 47.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.183 0.516 . . . . 0.0 111.674 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.629 HG13 HG23 ' A' ' 44' ' ' THR . 2.0 p -87.64 118.17 32.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.386 -0.825 . . . . 0.0 109.22 178.215 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 1.097 HD13 HD13 ' A' ' 107' ' ' ILE . 89.2 mt -73.5 -30.72 63.31 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -178.67 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.409 ' HB2' ' HB2' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -53.14 -24.3 10.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.819 0.342 . . . . 0.0 111.69 -179.486 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.629 HG23 HG13 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -92.58 -24.67 18.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.103 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.768 HD12 ' HB3' ' A' ' 62' ' ' LEU . 39.2 mm -61.25 85.44 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.712 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -70.81 -29.04 65.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.543 -179.323 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.66 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 10.0 mmmt -139.35 146.44 40.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.024 0.44 . . . . 0.0 111.789 -179.234 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.645 HD23 ' HG2' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -126.74 126.36 43.34 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.741 179.138 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -119.87 149.45 42.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.971 0.415 . . . . 0.0 111.236 -179.243 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.701 ' HB3' ' NZ ' ' A' ' 101' ' ' LYS . . . -148.08 146.76 28.97 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.953 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 54.6 p -75.87 122.73 87.57 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.332 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -61.42 160.32 27.99 Favored 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 122.597 2.198 . . . . 0.0 112.578 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.453 ' HB2' ' NH2' ' A' ' 94' ' ' ARG . . . -59.68 -42.75 93.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.103 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 86.3 p -57.92 -26.94 62.87 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.044 0.45 . . . . 0.0 110.783 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.7 t -85.69 118.57 25.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.845 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -56.69 -18.5 12.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.542 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -63.54 147.1 52.31 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.954 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.44 ' HE3' ' HB3' ' A' ' 58' ' ' MET . 19.6 mmm -133.74 85.0 2.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.592 -179.832 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.426 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 31.7 mtm -154.67 165.87 35.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.229 0.538 . . . . 0.0 112.002 -179.469 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.445 HD12 ' HB2' ' A' ' 50' ' ' ALA . 2.8 tp -133.79 126.81 31.4 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.997 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.1 ttt180 -117.1 127.18 53.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.928 0.394 . . . . 0.0 111.882 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.768 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -106.42 144.1 33.59 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.269 179.482 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.66 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 2.0 mm -111.27 126.04 68.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.818 0.342 . . . . 0.0 111.211 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -91.25 131.91 11.01 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.2 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -44.3 137.84 3.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.847 0.356 . . . . 0.0 111.245 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.757 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.4 p -93.85 -162.39 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.052 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.757 ' H ' HG22 ' A' ' 66' ' ' VAL . 52.1 t0 -167.38 73.28 0.12 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.088 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 85.6 mt-10 -55.11 -21.97 14.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.439 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 37.1 m -57.06 -19.01 16.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.174 179.69 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.78 -54.57 43.56 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.986 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.5 mmtt 60.92 93.64 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.838 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 10.8 mtt180 -111.22 143.83 41.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.835 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.1 mttp -98.48 145.21 27.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.168 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -87.65 175.25 7.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.899 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -64.31 -19.52 65.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.39 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 51.8 mp0 -86.95 6.39 32.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.59 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.47 14.59 82.33 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.766 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -104.65 148.96 25.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.767 0.317 . . . . 0.0 110.548 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -82.62 142.82 31.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.874 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.458 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.3 m -134.3 158.87 42.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.224 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 30.7 t -101.38 98.81 9.78 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.724 178.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.458 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 95.3 Cg_exo -42.99 145.4 1.17 Allowed 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.491 2.127 . . . . 0.0 112.681 -178.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.486 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 15.4 mttt -82.67 147.8 56.38 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.057 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 13.8 Cg_exo -74.18 160.69 42.09 Favored 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 123.394 2.729 . . . . 0.0 112.713 -179.121 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.53 151.31 46.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.668 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.81 120.99 7.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.096 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -99.48 158.47 15.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.419 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.2 ttt -133.62 132.46 40.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.026 0.441 . . . . 0.0 111.477 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.583 ' CD2' HD11 ' A' ' 16' ' ' ILE . 96.6 m-85 -138.93 146.25 40.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.367 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.426 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 6.1 t -121.96 133.76 54.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.948 0.404 . . . . 0.0 111.282 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.654 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 3.3 m-85 -123.47 171.26 9.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.718 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -130.89 20.49 4.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.171 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.442 ' ND2' HG23 ' A' ' 96' ' ' VAL . 45.1 t-20 -152.1 113.98 4.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.812 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.453 ' NH2' ' HB2' ' A' ' 53' ' ' ALA . 17.6 mmm180 -55.62 -31.74 62.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.914 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.03 -55.05 14.03 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.043 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.442 HG23 ' ND2' ' A' ' 93' ' ' ASN . 57.6 t -59.06 -47.68 89.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.338 179.449 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.436 ' HG3' ' CD1' ' A' ' 91' ' ' PHE . 16.4 ttp -64.46 -29.45 70.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.96 179.091 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -65.6 -34.08 77.41 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.403 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.428 ' O ' ' HB ' ' A' ' 103' ' ' THR . 22.3 m120 -69.15 -40.44 78.2 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.591 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.571 HD12 ' CG2' ' A' ' 16' ' ' ILE . 24.3 mm -65.56 -52.12 54.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.739 179.68 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.701 ' NZ ' ' HB3' ' A' ' 50' ' ' ALA . 1.0 OUTLIER -63.07 -28.28 69.98 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.85 179.794 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 40.7 mtm -78.78 -40.81 32.13 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.66 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.428 ' HB ' ' O ' ' A' ' 99' ' ' ASN . 0.6 OUTLIER -75.52 -36.71 60.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.896 -179.97 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.715 ' HA ' HD12 ' A' ' 107' ' ' ILE . 13.5 mt -62.24 -40.37 95.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.876 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.798 ' HA ' HD12 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -62.32 -27.66 69.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.949 179.77 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -69.39 -40.36 77.44 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.996 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.097 HD13 HD13 ' A' ' 42' ' ' LEU . 4.0 mt -65.58 -44.99 93.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.296 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.798 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.1 mt -59.7 -61.0 1.66 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.608 0 CA-C-O 121.692 0.758 . . . . 0.0 109.259 179.057 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.5 t -50.97 -28.96 10.99 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.301 -1.318 . . . . 0.0 110.906 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 53.5 mtt-85 -68.48 -33.75 74.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.06 0.457 . . . . 0.0 110.576 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -105.44 -1.2 25.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.892 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.401 ' N ' ' O ' ' A' ' 108' ' ' ILE . 0.7 OUTLIER . . . . . 0 C--N 1.331 -0.238 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.821 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.6 p . . . . . 0 C--O 1.233 0.188 0 CA-C-O 120.653 0.263 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.459 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 50.5 m80 65.74 35.76 6.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.094 0.473 . . . . 0.0 111.373 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.49 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 68.5 p -178.35 152.05 0.65 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.908 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.404 ' CA ' ' CG1' ' A' ' 96' ' ' VAL . . . 176.17 116.53 0.46 Allowed Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.139 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.633 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -46.77 104.35 0.05 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.146 0.498 . . . . 0.0 111.386 -179.59 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.682 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -119.26 152.4 36.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.753 -178.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.645 HG23 ' O ' ' A' ' 12' ' ' VAL . 0.9 OUTLIER -100.63 125.76 54.4 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.267 0 CA-C-O 121.09 0.471 . . . . 0.0 110.469 179.0 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.506 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 4.3 t80 -113.3 130.78 56.17 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.125 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 81.8 mt-10 55.88 35.0 24.63 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.046 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 42.9 mtpt 75.78 1.49 3.55 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.362 -179.126 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.645 ' O ' HG23 ' A' ' 8' ' ' ILE . 41.0 t -99.8 155.46 4.14 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.616 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.554 ' HA ' HG13 ' A' ' 8' ' ' ILE . 71.9 p -98.44 148.58 23.57 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.572 0.701 . . . . 0.0 112.643 -178.642 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.482 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.86 -179.58 46.91 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 114.595 -1.184 . . . . 0.0 110.344 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.633 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.69 142.15 20.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 117.613 0.707 . . . . 0.0 110.465 179.344 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.855 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.68 118.45 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.766 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.561 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.426 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -119.3 137.79 53.45 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.234 -178.565 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.721 HD12 ' CG2' ' A' ' 103' ' ' THR . 64.8 mt -110.66 140.11 31.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.094 -179.101 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 -132.27 111.63 11.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.08 -179.636 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -91.14 3.44 54.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.2 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -78.81 -17.23 56.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.883 0.373 . . . . 0.0 110.469 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.87 141.66 16.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.941 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.469 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.3 t -114.37 116.58 43.94 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.747 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.469 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 1.6 Cg_endo -81.33 142.62 56.22 Favored 'Cis proline' 0 C--N 1.347 0.489 0 C-N-CA 123.818 -1.326 . . . . 0.0 111.904 -0.068 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.06 141.59 3.17 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.054 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -135.77 167.12 21.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.102 0.477 . . . . 0.0 111.739 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.855 HD21 HG12 ' A' ' 16' ' ' ILE . 4.5 tt -121.26 129.84 53.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.582 179.43 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.7 m -117.34 126.82 53.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.225 0.536 . . . . 0.0 112.156 -178.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.485 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 58.8 t90 -100.62 128.3 46.72 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.895 178.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.6 tpt180 -124.98 116.94 22.95 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.783 0.325 . . . . 0.0 111.065 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.482 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 12.5 m -45.49 166.23 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.01 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.75 -41.63 64.93 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.517 0.675 . . . . 0.0 109.526 179.558 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -84.66 -20.0 31.99 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.006 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.39 33.6 11.49 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.41 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -100.7 -22.85 14.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.658 0.266 . . . . 0.0 111.446 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 4.5 mtmt -130.23 137.56 50.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.777 0.322 . . . . 0.0 111.025 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 14.6 p -139.16 132.31 38.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.059 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.506 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 22.2 t-80 -131.38 145.94 52.05 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.045 0.45 . . . . 0.0 111.222 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 48.5 m -129.12 134.48 48.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.025 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.9 t -126.71 140.81 47.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.031 0.443 . . . . 0.0 111.447 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.633 HG22 HG23 ' A' ' 44' ' ' THR . 1.9 p -85.54 117.55 30.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.218 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 1.018 HD13 HD13 ' A' ' 107' ' ' ILE . 83.6 mt -75.39 -31.69 60.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.244 -0.434 . . . . 0.0 112.097 -178.552 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.446 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 10.9 t -53.95 -23.36 12.76 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -179.072 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.633 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -92.07 -21.24 20.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.716 0.293 . . . . 0.0 111.014 -179.736 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.86 HD12 ' HB3' ' A' ' 62' ' ' LEU . 36.4 mm -57.75 87.03 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.995 0.426 . . . . 0.0 111.067 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.416 ' N ' ' O ' ' A' ' 63' ' ' ILE . 21.8 t70 -64.77 -32.57 74.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.0 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.703 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 4.4 mmmt -142.67 149.7 39.22 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.055 0.455 . . . . 0.0 111.28 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.595 HD21 ' HG3' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -131.98 125.95 32.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.778 179.175 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -136.79 158.91 43.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.994 0.426 . . . . 0.0 111.431 -179.056 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 1.086 ' HB2' HD12 ' A' ' 60' ' ' LEU . . . -148.12 166.49 27.7 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.958 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.451 HG23 ' HB3' ' A' ' 59' ' ' MET . 81.4 p -75.65 148.33 82.49 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.823 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.82 149.59 86.56 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.587 2.191 . . . . 0.0 112.362 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.82 -36.38 83.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.176 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.6 t -59.96 -26.29 65.88 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.994 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 24.1 t -86.62 117.09 25.16 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.918 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -56.98 -18.62 14.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.539 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.4 mttp -83.95 127.88 34.16 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.945 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.416 ' HB3' ' O ' ' A' ' 91' ' ' PHE . 2.0 ttm -102.02 149.88 23.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.935 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.451 ' HB3' HG23 ' A' ' 51' ' ' THR . 0.0 OUTLIER 178.38 138.91 0.09 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.914 0.388 . . . . 0.0 111.269 179.652 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 1.086 HD12 ' HB2' ' A' ' 50' ' ' ALA . 7.6 tp -126.1 123.92 39.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.122 179.463 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 20.8 mmt85 -110.14 123.56 49.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.929 0.395 . . . . 0.0 111.72 -179.298 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.86 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -109.25 128.07 54.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.372 179.466 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.703 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -105.63 122.69 59.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.576 -0.283 . . . . 0.0 110.986 179.871 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.89 -129.27 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.464 -0.874 . . . . 0.0 111.843 179.106 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.3 mttp -130.13 155.08 46.79 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.629 0.252 . . . . 0.0 110.516 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.75 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.2 p -118.78 -164.01 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.928 0.395 . . . . 0.0 111.243 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.75 ' H ' HG22 ' A' ' 66' ' ' VAL . 21.1 t70 -178.94 75.66 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.186 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.496 ' HG3' HG23 ' A' ' 81' ' ' VAL . 55.7 mp0 -55.0 -22.49 15.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.446 -179.412 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 37.6 m -58.24 -18.34 25.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.127 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.2 -61.4 1.83 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.907 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp 62.96 94.4 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.94 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.6 mtt180 -97.15 141.49 30.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.984 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.419 ' HA ' ' HA ' ' A' ' 79' ' ' GLU . 55.8 mmtt -78.76 145.13 34.57 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.911 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.499 ' HB3' HG11 ' A' ' 80' ' ' VAL . 37.3 p30 -97.23 175.85 6.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.068 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -60.59 -19.68 58.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.333 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -87.08 7.48 27.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.512 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.78 13.7 80.4 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.738 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -111.01 145.42 38.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.825 0.345 . . . . 0.0 110.845 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.419 ' HA ' ' HA ' ' A' ' 73' ' ' LYS . 96.9 mt-10 -72.16 143.13 49.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.069 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.499 HG11 ' HB3' ' A' ' 74' ' ' ASP . 1.3 m -140.59 151.82 20.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.072 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.496 HG23 ' HG3' ' A' ' 68' ' ' GLU . 2.3 p -85.62 108.62 17.1 Favored Pre-proline 0 C--N 1.319 -0.745 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.62 178.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.462 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 46.0 Cg_exo -56.72 145.98 79.64 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.125 1.883 . . . . 0.0 112.257 -178.932 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.413 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 18.6 mtmt -83.12 148.12 55.62 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.034 0.445 . . . . 0.0 110.882 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 13.2 Cg_exo -74.28 158.71 44.64 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 C-N-CA 123.342 2.695 . . . . 0.0 112.695 -179.032 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.47 136.31 56.28 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.61 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 32.2 mtm105 -134.69 138.31 44.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.852 0.358 . . . . 0.0 111.214 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -118.15 157.03 27.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.358 179.563 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 8.5 ttt -133.58 120.48 20.79 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.95 0.405 . . . . 0.0 111.372 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.642 ' CE2' HD11 ' A' ' 16' ' ' ILE . 97.0 m-85 -126.24 133.05 51.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.574 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -106.09 133.63 50.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.885 0.374 . . . . 0.0 111.147 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.682 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 2.5 m-85 -122.74 170.45 10.05 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.575 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -121.57 -22.83 5.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.801 0.334 . . . . 0.0 111.304 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -108.1 100.2 9.56 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.38 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -47.8 -30.16 3.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.111 0.481 . . . . 0.0 111.111 -179.713 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.45 -47.58 54.82 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.227 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.404 ' CG1' ' CA ' ' A' ' 5' ' ' GLY . 57.5 t -61.31 -50.22 81.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.395 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.829 ' HE3' ' HB1' ' A' ' 50' ' ' ALA . 41.8 ttp -62.49 -29.61 70.67 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -60.31 -34.49 73.86 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 121.098 0.475 . . . . 0.0 109.953 179.137 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 22.4 m120 -71.56 -33.68 69.31 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.891 178.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.508 HG21 HD22 ' A' ' 60' ' ' LEU . 19.6 mm -61.8 -47.83 91.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.586 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.651 ' HD3' ' HB3' ' A' ' 50' ' ' ALA . 13.4 mttt -67.47 -27.97 67.47 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.21 0.528 . . . . 0.0 110.357 179.354 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 77.5 mtp -78.55 -39.41 37.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.505 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.721 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -76.43 -40.54 50.39 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.714 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.743 ' HA ' HD12 ' A' ' 107' ' ' ILE . 18.9 mt -63.78 -36.83 85.19 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.85 0.357 . . . . 0.0 110.516 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.757 ' HA ' HD12 ' A' ' 108' ' ' ILE . 20.7 mt-30 -63.3 -29.37 70.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.973 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -68.98 -31.5 70.39 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.141 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.018 HD13 HD13 ' A' ' 42' ' ' LEU . 4.2 mt -76.49 -46.15 32.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.479 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.945 HG22 ' CD ' ' A' ' 112' ' ' LYS . 2.2 mt -57.1 -61.38 1.28 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.568 0 CA-C-O 121.746 0.784 . . . . 0.0 109.544 179.326 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 18.2 t -50.27 -28.84 8.4 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.396 -1.275 . . . . 0.0 110.462 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.36 -35.01 79.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.671 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -89.55 -31.28 17.69 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.869 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.945 ' CD ' HG22 ' A' ' 108' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.255 0 CA-C-O 120.956 0.408 . . . . 0.0 110.603 179.625 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.861 0.362 . . . . 0.0 111.019 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 79.4 m80 64.16 33.44 11.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.234 0.54 . . . . 0.0 110.981 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.615 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 53.0 p 179.33 174.62 0.75 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.62 179.086 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.409 ' HA3' HG13 ' A' ' 96' ' ' VAL . . . 153.53 120.03 0.77 Allowed Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.466 -0.874 . . . . 0.0 112.522 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.628 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -47.21 105.76 0.07 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.151 0.501 . . . . 0.0 111.34 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.759 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -120.49 151.52 39.25 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.761 -178.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.567 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -99.67 124.26 52.94 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.256 0 CA-C-O 121.014 0.435 . . . . 0.0 110.29 179.046 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.489 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 16.9 t80 -112.7 130.38 56.08 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.112 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.42 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 83.4 mt-10 56.4 34.21 23.79 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.037 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.0 mttm 76.24 1.35 3.39 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.249 -179.121 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.529 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.6 t -99.71 154.42 4.26 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.671 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 178.869 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.567 ' HA ' HG13 ' A' ' 8' ' ' ILE . 78.0 p -97.31 148.47 23.1 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-O 121.604 0.716 . . . . 0.0 112.546 -178.749 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.462 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.59 -179.72 46.61 Favored Glycine 0 N--CA 1.447 -0.627 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.397 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.628 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.66 142.2 20.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 117.74 0.77 . . . . 0.0 110.521 179.369 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.706 HD11 ' CE2' ' A' ' 89' ' ' PHE . 0.1 OUTLIER -106.69 118.56 54.64 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.758 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 179.557 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.499 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -121.3 134.46 55.15 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.315 -178.658 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.533 HD12 ' CG2' ' A' ' 103' ' ' THR . 96.7 mt -111.04 140.09 31.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.194 -179.158 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -128.72 112.65 14.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.004 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -87.36 6.16 34.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.267 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -78.34 -18.31 55.34 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.912 0.387 . . . . 0.0 110.411 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -100.39 146.76 8.57 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.859 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.401 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.5 t -121.51 115.5 31.07 Favored Pre-proline 0 CA--C 1.532 0.269 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.957 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.433 ' HB3' ' CB ' ' A' ' 43' ' ' SER . 5.6 Cg_exo -77.67 145.28 79.06 Favored 'Cis proline' 0 C--N 1.348 0.501 0 C-N-CA 123.633 -1.403 . . . . 0.0 111.842 -0.078 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.678 ' O ' HD22 ' A' ' 42' ' ' LEU . . . -44.15 140.81 1.98 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.818 0.342 . . . . 0.0 110.916 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -124.69 157.72 34.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.132 0.491 . . . . 0.0 111.716 -179.313 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.694 ' HB2' HD11 ' A' ' 42' ' ' LEU . 4.4 tt -121.28 128.9 52.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.494 179.401 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.9 m -119.63 125.79 49.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.143 0.496 . . . . 0.0 112.168 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.489 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 60.2 t90 -100.49 127.79 46.74 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.727 178.94 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 44.8 ttp85 -122.0 117.15 25.68 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.798 0.333 . . . . 0.0 111.013 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.462 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 64.0 m -46.66 162.93 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.913 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.83 -41.57 68.0 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.536 0.684 . . . . 0.0 109.551 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -82.14 -21.14 36.78 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.803 -1.09 . . . . 0.0 111.044 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.09 34.48 12.64 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.329 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 51.9 t0 -104.0 -19.4 14.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.615 0.245 . . . . 0.0 111.614 -179.678 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.57 142.17 45.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.888 0.375 . . . . 0.0 111.327 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 48.6 t -139.26 138.05 40.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.925 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.489 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 16.6 t-80 -134.55 145.77 49.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.207 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.449 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 43.5 m -129.31 134.86 48.12 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.175 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 90.8 t -135.04 139.69 46.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 CA-C-O 121.127 0.489 . . . . 0.0 111.836 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.565 HG22 HG23 ' A' ' 44' ' ' THR . 1.6 p -88.63 117.46 32.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.505 177.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.766 ' H ' HD22 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -73.95 -28.28 61.43 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -179.035 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.433 ' CB ' ' HB3' ' A' ' 24' ' ' PRO . 11.9 t -55.96 -21.59 21.77 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.157 0.429 . . . . 0.0 112.157 -179.161 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.565 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -96.54 -21.9 17.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.833 0.349 . . . . 0.0 111.413 -179.446 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.918 HD12 ' HB3' ' A' ' 62' ' ' LEU . 47.6 mm -53.18 94.19 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.028 0.442 . . . . 0.0 111.053 -179.751 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -61.15 -28.87 69.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.393 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.615 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 16.3 mttm -153.41 162.92 40.78 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.167 0.508 . . . . 0.0 111.603 -179.711 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.796 HD11 ' HB3' ' A' ' 104' ' ' LEU . 22.2 mt -123.88 124.36 42.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.362 179.309 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -111.07 130.34 55.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.621 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.585 ' HB3' ' NZ ' ' A' ' 101' ' ' LYS . . . -145.81 138.84 25.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.218 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.547 HG21 ' HB3' ' A' ' 57' ' ' LYS . 57.2 p -75.75 122.05 86.29 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.496 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -62.6 160.54 31.83 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.563 2.175 . . . . 0.0 112.49 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.92 -43.14 91.06 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.131 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.2 m -60.85 -27.71 68.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.06 0.457 . . . . 0.0 110.63 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 26.3 t -79.48 122.03 25.93 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.97 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -56.61 -18.74 13.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.284 179.149 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.547 ' HB3' HG21 ' A' ' 51' ' ' THR . 12.1 mptt -65.46 151.83 45.4 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.72 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.514 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 48.5 mtp -143.0 79.82 1.66 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.98 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -155.71 169.02 25.32 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.016 0.436 . . . . 0.0 111.569 -179.783 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.682 HD23 HD11 ' A' ' 62' ' ' LEU . 0.4 OUTLIER -135.85 126.82 27.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.147 179.554 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 32.8 mtp180 -119.06 129.9 55.34 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.93 0.395 . . . . 0.0 111.657 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.918 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -106.1 141.81 36.85 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.397 179.613 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.615 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.1 mm -105.15 112.84 40.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.687 0.279 . . . . 0.0 111.326 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -83.82 125.36 7.03 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.605 -0.807 . . . . 0.0 112.36 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 50.6 mttt -49.46 153.6 1.07 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.826 0.346 . . . . 0.0 111.185 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.718 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.3 p -117.65 -161.9 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.061 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.718 ' H ' HG22 ' A' ' 66' ' ' VAL . 23.5 m-20 -167.37 62.21 0.08 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.496 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -49.58 -28.27 5.47 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.402 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 36.9 m -54.44 -18.83 4.66 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.118 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.7 mmtp -62.44 -37.3 85.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.858 0.361 . . . . 0.0 110.988 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.6 mptt 61.37 93.48 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.864 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 -104.72 157.3 17.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.861 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -111.27 145.5 38.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.896 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.405 ' HB3' HG11 ' A' ' 80' ' ' VAL . 35.7 p30 -93.07 174.45 7.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.987 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -62.14 -18.36 60.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.393 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -86.95 7.98 25.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.556 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.93 11.25 81.23 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.718 -0.754 . . . . 0.0 112.694 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -106.55 146.09 31.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.844 0.354 . . . . 0.0 110.709 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -73.77 148.83 42.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.971 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.477 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.4 m -136.11 159.05 38.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.982 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.9 t -100.54 98.74 8.54 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.701 178.809 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.477 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 79.8 Cg_exo -44.17 145.13 2.42 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.402 2.068 . . . . 0.0 112.789 -179.085 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.439 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 8.6 mtmt -95.11 151.05 38.53 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.879 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 18.0 Cg_exo -71.4 143.43 43.14 Favored 'Trans proline' 0 N--CA 1.465 -0.198 0 C-N-CA 123.48 2.786 . . . . 0.0 112.746 -178.949 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.1 mm-40 -65.37 151.47 46.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.02 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 90.5 mtt180 -148.79 119.78 7.68 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.565 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -98.71 150.88 21.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.759 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -128.47 122.23 30.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.13 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.706 ' CE2' HD11 ' A' ' 16' ' ' ILE . 93.2 m-85 -127.2 155.1 43.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.604 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 35.7 t -129.35 134.96 48.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.906 0.384 . . . . 0.0 110.953 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.759 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 3.0 m-85 -127.48 147.99 50.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.685 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.514 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 47.6 m-20 -95.33 -24.03 16.92 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.242 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.493 ' HB2' HG23 ' A' ' 96' ' ' VAL . 92.6 m-20 -106.59 115.53 30.35 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.806 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -57.29 -31.28 65.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.936 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.02 -45.06 90.58 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.233 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.493 HG23 ' HB2' ' A' ' 93' ' ' ASN . 57.4 t -58.24 -44.19 87.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.754 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.438 ' HG2' ' CG ' ' A' ' 91' ' ' PHE . 3.2 mtm -60.72 -32.24 71.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.316 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.517 ' O ' ' HE2' ' A' ' 102' ' ' MET . 48.8 t0 -64.06 -29.98 71.09 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.881 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -80.89 -50.17 10.1 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.02 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.527 HD12 ' CG2' ' A' ' 16' ' ' ILE . 23.5 mm -58.68 -52.26 62.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.005 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.585 ' NZ ' ' HB3' ' A' ' 50' ' ' ALA . 2.2 ttmt -61.16 -32.08 71.81 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.952 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.517 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 33.4 mtm -78.86 -40.36 32.76 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.166 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.533 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -72.16 -41.32 67.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.275 -179.552 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.796 ' HB3' HD11 ' A' ' 48' ' ' LEU . 12.5 mt -64.05 -38.42 91.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.789 0.328 . . . . 0.0 110.775 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.772 ' HA ' HD12 ' A' ' 108' ' ' ILE . 2.2 mt-30 -65.61 -28.81 69.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.764 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -68.52 -35.94 78.16 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.673 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.746 HD13 HD23 ' A' ' 42' ' ' LEU . 57.8 mt -68.35 -46.7 80.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.081 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.772 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.2 mt -59.02 -61.12 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.508 -0.637 0 CA-C-O 121.809 0.814 . . . . 0.0 109.218 179.099 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 8.5 t -50.53 -28.72 9.07 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.379 -1.282 . . . . 0.0 110.434 179.1 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.45 -48.94 68.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.412 0.625 . . . . 0.0 109.841 179.336 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.403 ' CE2' ' CB ' ' A' ' 43' ' ' SER . 39.4 m-85 -75.36 -28.99 59.77 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.291 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.48 ' HE2' HG22 ' A' ' 108' ' ' ILE . 11.4 mttm . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.662 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.1 m . . . . . 0 C--O 1.23 0.046 0 CA-C-O 120.892 0.377 . . . . 0.0 110.892 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.419 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 54.8 m80 -113.05 34.0 4.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.164 0.507 . . . . 0.0 111.046 -179.722 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.493 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 36.5 p -170.48 145.42 2.61 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.547 179.137 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -177.69 116.91 0.56 Allowed Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.375 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.63 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -45.65 105.15 0.06 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.094 0.473 . . . . 0.0 111.437 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.761 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -120.59 151.42 39.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.905 -178.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.555 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -100.3 124.55 53.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.998 0.428 . . . . 0.0 110.425 179.145 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.501 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 11.1 t80 -112.79 130.58 56.03 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.179 179.881 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 56.14 34.24 23.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.007 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 25.8 mttp 76.38 1.06 3.32 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.334 -179.061 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.541 ' O ' HG23 ' A' ' 8' ' ' ILE . 41.7 t -99.35 154.93 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.633 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 178.904 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.555 ' HA ' HG13 ' A' ' 8' ' ' ILE . 98.1 p -98.05 148.72 23.23 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-O 121.67 0.748 . . . . 0.0 112.794 -178.647 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.453 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 175.52 -179.79 46.51 Favored Glycine 0 N--CA 1.446 -0.672 0 CA-C-N 114.452 -1.249 . . . . 0.0 110.285 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.63 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.61 143.13 17.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 117.688 0.744 . . . . 0.0 110.403 179.372 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.827 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.58 118.26 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 CA-C-N 115.335 -0.848 . . . . 0.0 108.767 179.575 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -121.52 124.58 44.75 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.2 0.524 . . . . 0.0 111.389 -178.545 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.736 HG23 HD11 ' A' ' 42' ' ' LEU . 53.6 mt -94.52 140.03 17.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.903 -179.54 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -127.37 111.53 13.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.079 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -95.81 5.39 51.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.239 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -79.71 -17.4 53.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.962 0.41 . . . . 0.0 110.538 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -102.96 145.39 12.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.938 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.404 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 4.4 t -119.67 116.41 33.24 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.86 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.413 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 73.0 Cg_endo -77.81 144.44 76.5 Favored 'Cis proline' 0 C--N 1.348 0.552 0 C-N-CA 123.491 -1.462 . . . . 0.0 112.332 0.09 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.411 ' HB1' HD12 ' A' ' 42' ' ' LEU . . . -50.7 151.4 2.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.88 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -137.62 165.75 25.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.201 0.524 . . . . 0.0 111.838 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.827 HD21 HG12 ' A' ' 16' ' ' ILE . 5.8 tt -121.24 121.98 38.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.325 179.426 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 41.0 m -112.56 124.93 53.64 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.603 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.482 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 56.3 t90 -100.65 127.74 46.95 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.875 178.809 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.17 118.33 27.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.852 0.358 . . . . 0.0 111.195 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.424 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 25.5 t -46.04 167.76 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.047 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.46 -42.43 59.07 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.481 0.658 . . . . 0.0 109.677 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 89.7 m-20 -89.11 -17.02 30.1 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.771 -1.104 . . . . 0.0 111.109 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.94 33.35 11.09 Favored Glycine 0 C--N 1.332 0.359 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.362 -179.824 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -95.46 -22.15 17.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.594 0.235 . . . . 0.0 111.492 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.6 143.08 37.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.826 0.346 . . . . 0.0 111.365 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 14.5 p -139.24 137.62 41.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.893 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.501 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 6.1 t-80 -131.28 145.64 51.97 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.97 0.414 . . . . 0.0 111.218 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 40.9 m -129.09 136.03 49.69 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.959 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.694 ' CG1' HD11 ' A' ' 45' ' ' ILE . 77.5 t -130.07 141.73 45.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.235 0.54 . . . . 0.0 111.788 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.713 ' HB ' HG23 ' A' ' 44' ' ' THR . 0.0 OUTLIER -85.31 118.11 31.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.649 178.029 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 1.001 HD13 HD13 ' A' ' 107' ' ' ILE . 27.6 mt -66.89 -19.55 65.75 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.804 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.413 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 6.5 t -67.76 -25.43 65.62 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.799 179.54 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.713 HG23 ' HB ' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -87.1 -37.68 17.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.825 179.864 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.857 HG23 ' HB2' ' A' ' 62' ' ' LEU . 8.9 mm -58.31 87.99 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.492 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -83.96 -25.53 29.97 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.77 -178.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.559 ' HB2' HG12 ' A' ' 63' ' ' ILE . 13.6 mttp -125.17 158.0 35.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.21 0.529 . . . . 0.0 111.902 -179.098 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.854 HD12 ' HG3' ' A' ' 105' ' ' GLN . 28.8 mt -131.44 128.84 40.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.556 179.168 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.419 ' N ' ' O ' ' A' ' 61' ' ' ARG . 35.8 tt0 -129.54 130.38 45.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.885 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.458 ' HB2' ' CD1' ' A' ' 60' ' ' LEU . . . -143.51 137.66 28.65 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.019 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.469 ' O ' ' HE1' ' A' ' 97' ' ' MET . 31.6 p -75.67 126.24 87.53 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.8 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.43 160.74 46.44 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.509 2.139 . . . . 0.0 112.449 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.801 ' HB2' ' NH1' ' A' ' 94' ' ' ARG . . . -56.96 -42.95 81.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.11 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.0 m -61.5 -27.64 68.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.052 0.453 . . . . 0.0 110.697 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.3 m -77.48 121.68 24.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.879 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -56.22 -18.82 11.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.322 179.122 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.54 140.88 42.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.774 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 33.3 mtp -130.89 79.92 1.92 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.737 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -150.83 168.75 23.49 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.135 0.493 . . . . 0.0 111.579 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.458 ' CD1' ' HB2' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -137.84 123.78 20.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.973 179.474 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.419 ' O ' ' N ' ' A' ' 49' ' ' GLN . 40.4 ttt180 -127.93 136.78 51.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.795 0.331 . . . . 0.0 111.689 -179.238 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.857 ' HB2' HG23 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -119.41 144.09 47.12 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.443 179.227 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.688 ' N ' HD13 ' A' ' 63' ' ' ILE . 1.1 mm -101.08 134.23 41.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.827 0.346 . . . . 0.0 110.986 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -82.73 153.22 31.13 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.186 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.432 ' N ' ' O ' ' A' ' 44' ' ' THR . 38.4 mttt -60.12 163.13 5.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.709 0.29 . . . . 0.0 110.735 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.79 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.4 p -116.9 -163.43 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 121.018 0.437 . . . . 0.0 111.279 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.79 ' H ' HG22 ' A' ' 66' ' ' VAL . 56.0 m-20 -160.59 71.14 0.43 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.092 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.421 ' HG2' HG13 ' A' ' 81' ' ' VAL . 96.6 mt-10 -55.51 -20.9 14.36 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.534 -179.251 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 31.0 m -53.71 -21.69 7.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.797 0.332 . . . . 0.0 111.124 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.8 mtmm -76.32 -48.71 19.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.965 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 60.66 92.83 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.949 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 10.9 mtm180 -94.48 129.25 41.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.824 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 79' ' ' GLU . 29.1 mmtp -81.21 145.3 31.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.045 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -92.65 179.83 5.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.955 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -64.93 -18.84 65.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.333 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -87.82 -2.84 58.87 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.274 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.69 8.23 73.77 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.699 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 22.7 p30 -105.58 145.99 30.24 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.883 0.373 . . . . 0.0 110.93 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.421 ' HA ' ' HA ' ' A' ' 73' ' ' LYS . 49.5 mt-10 -71.83 143.78 49.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.92 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.444 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.8 m -138.86 158.77 30.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.165 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.421 HG13 ' HG2' ' A' ' 68' ' ' GLU . 37.4 t -83.88 110.22 24.01 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.434 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.444 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 88.3 Cg_exo -46.8 169.67 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.217 1.944 . . . . 0.0 112.758 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.498 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.1 OUTLIER -90.4 95.88 0.81 Allowed Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.215 -179.873 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.498 ' HD2' ' HA ' ' A' ' 83' ' ' LYS . 7.9 Cg_endo -46.53 161.45 0.18 Allowed 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 123.41 2.74 . . . . 0.0 112.363 179.289 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -65.48 159.92 23.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.655 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.641 ' HG2' HD12 ' A' ' 63' ' ' ILE . 6.2 mtp180 -155.23 133.15 11.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.24 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -118.52 133.3 55.98 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.314 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 22.7 ttt -113.95 137.29 51.88 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.986 0.422 . . . . 0.0 111.47 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.478 ' CE1' HD11 ' A' ' 16' ' ' ILE . 99.0 m-85 -139.27 151.22 46.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.486 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -123.27 135.24 54.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.893 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.761 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 2.8 m-85 -128.42 160.31 32.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.951 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 68.4 m-20 -110.64 9.96 22.89 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.277 179.499 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -141.64 107.75 5.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.636 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.801 ' NH1' ' HB2' ' A' ' 53' ' ' ALA . 1.9 tmm_? -49.02 -30.28 5.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.272 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.56 -55.11 6.73 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.451 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 56.4 t -55.39 -48.17 77.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.873 0.368 . . . . 0.0 110.707 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.469 ' HE1' ' O ' ' A' ' 51' ' ' THR . 15.4 ptm -63.82 -38.03 89.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.917 179.148 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -61.47 -34.36 75.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.365 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.431 ' O ' ' HB ' ' A' ' 103' ' ' THR . 81.6 m-20 -66.92 -41.45 87.06 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.631 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.594 HD12 ' CG2' ' A' ' 16' ' ' ILE . 27.2 mm -60.69 -52.37 62.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.853 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.633 ' O ' HD13 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -67.16 -27.87 67.65 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.254 179.534 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 39.7 mtm -78.11 -36.89 47.43 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.72 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.448 HG22 HD13 ' A' ' 18' ' ' ILE . 0.5 OUTLIER -79.47 -39.85 31.21 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.497 179.815 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.704 ' CD2' HD22 ' A' ' 42' ' ' LEU . 28.1 mt -59.99 -35.69 75.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.764 179.729 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.854 ' HG3' HD12 ' A' ' 48' ' ' LEU . 1.9 mt-30 -61.39 -32.18 72.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.796 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -65.64 -28.17 68.91 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.076 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.001 HD13 HD13 ' A' ' 42' ' ' LEU . 3.1 mt -81.11 -44.14 20.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.634 -179.58 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.659 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.2 mt -58.19 -61.35 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.585 0 CA-C-O 121.603 0.716 . . . . 0.0 109.444 179.402 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.7 p -49.08 -31.14 7.37 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.48 -1.236 . . . . 0.0 110.366 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -61.78 -41.8 98.18 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.568 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -85.3 -29.07 24.85 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.428 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.425 ' HE2' HG22 ' A' ' 108' ' ' ILE . 11.6 mttm . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.524 179.424 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.527 0.086 0 CA-C-O 120.901 0.382 . . . . 0.0 111.08 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 75.6 m80 63.93 31.9 13.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.195 0.521 . . . . 0.0 111.042 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.631 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 88.4 p 178.15 172.7 0.66 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.744 178.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.407 ' CA ' ' CG1' ' A' ' 96' ' ' VAL . . . 154.64 116.32 0.57 Allowed Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.746 -0.74 . . . . 0.0 111.966 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.583 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -40.39 117.56 0.82 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.846 0.355 . . . . 0.0 111.144 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.669 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -132.67 149.7 52.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.844 -178.91 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.596 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.1 mp -97.46 124.2 50.25 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 CA-C-O 121.023 0.44 . . . . 0.0 110.528 179.282 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.506 ' CD1' ' CE2' ' A' ' 89' ' ' PHE . 10.1 t80 -115.8 129.4 56.42 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.927 179.658 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 58.71 33.91 23.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.794 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.0 mttp 75.63 1.64 3.62 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.142 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.542 HG21 ' NZ ' ' A' ' 36' ' ' LYS . 32.7 t -100.94 151.42 5.34 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.694 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.596 ' HA ' HG13 ' A' ' 8' ' ' ILE . 85.3 p -90.36 145.89 24.6 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 121.435 0.636 . . . . 0.0 111.678 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.438 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -176.64 -179.22 46.96 Favored Glycine 0 N--CA 1.444 -0.817 0 CA-C-N 114.979 -1.009 . . . . 0.0 111.691 -179.693 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.583 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.9 mm -105.61 137.52 35.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 121.034 0.445 . . . . 0.0 110.194 179.667 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.753 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.1 OUTLIER -106.54 117.92 53.24 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.672 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.564 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -124.4 131.07 53.5 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.366 -177.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.766 HG23 HD11 ' A' ' 42' ' ' LEU . 89.0 mt -106.45 140.04 25.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.27 -179.261 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -132.25 112.49 12.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.971 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -90.95 6.14 45.85 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.215 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -79.44 -17.53 54.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.872 0.368 . . . . 0.0 110.529 179.324 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -100.2 143.27 14.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.972 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.445 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.9 t -115.15 116.26 42.36 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.821 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.445 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 1.8 Cg_endo -80.52 143.64 64.55 Favored 'Cis proline' 0 C--N 1.349 0.576 0 C-N-CA 123.701 -1.374 . . . . 0.0 111.928 -0.02 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.21 141.3 4.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.732 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 68.4 mt-10 -134.5 166.24 23.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.172 0.51 . . . . 0.0 111.877 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.677 HD21 HG12 ' A' ' 16' ' ' ILE . 5.5 tt -121.33 127.58 51.43 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.555 179.32 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 41.0 m -116.6 129.61 56.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.212 0.53 . . . . 0.0 112.13 -178.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.496 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 56.3 t90 -100.47 125.69 46.81 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.984 178.877 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -122.61 117.3 25.52 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.71 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.412 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 30.3 t -44.48 158.96 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.752 0.311 . . . . 0.0 110.88 -179.708 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.438 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -66.42 -39.48 88.97 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 121.616 0.722 . . . . 0.0 109.352 179.9 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 42.8 p30 -89.46 -18.93 25.78 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.296 179.834 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.04 32.0 11.3 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.672 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -99.29 -18.88 17.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.725 0.297 . . . . 0.0 111.467 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.542 ' NZ ' HG21 ' A' ' 12' ' ' VAL . 8.8 mtmt -134.97 140.6 45.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.089 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.2 t -139.11 137.09 42.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.897 0.38 . . . . 0.0 111.294 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.506 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 82.5 t60 -137.7 146.3 43.6 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.088 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 47.8 m -129.07 138.0 51.6 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.216 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.5 t -132.15 140.87 46.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 121.095 0.474 . . . . 0.0 111.421 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.574 HG22 HG23 ' A' ' 44' ' ' THR . 2.3 p -86.02 117.84 31.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.051 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 1.055 HD13 HD13 ' A' ' 107' ' ' ILE . 78.7 mt -75.47 -31.2 60.17 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.095 0.405 . . . . 0.0 112.095 -178.539 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.421 ' HB3' ' HB3' ' A' ' 24' ' ' PRO . 58.3 p -55.63 -21.86 19.81 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.122 0.415 . . . . 0.0 112.122 -178.963 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.574 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -96.28 -21.84 17.59 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.756 0.312 . . . . 0.0 111.271 -179.785 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.606 HD12 ' HB3' ' A' ' 62' ' ' LEU . 38.0 mm -50.19 95.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.059 0.457 . . . . 0.0 111.039 -179.755 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -67.68 -27.94 67.26 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.317 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.602 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 38.4 mttm -156.72 159.89 38.79 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.045 0.45 . . . . 0.0 111.569 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.578 HD23 ' HG3' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -131.73 128.16 38.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.777 179.357 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.787 ' O ' HD23 ' A' ' 60' ' ' LEU . 93.0 mt-30 -119.59 141.02 49.65 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.937 0.399 . . . . 0.0 111.071 -179.363 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.85 143.25 31.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.992 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.693 HG23 ' O ' ' A' ' 59' ' ' MET . 43.0 p -75.7 111.21 13.33 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.597 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -64.56 160.59 39.09 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.559 2.173 . . . . 0.0 112.621 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.21 -41.84 72.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.186 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.0 m -58.12 -27.54 63.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.115 0.484 . . . . 0.0 110.788 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 31.4 t -86.29 118.65 25.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.817 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -57.18 -18.36 15.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.476 179.321 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -72.95 145.64 46.62 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.061 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 59.1 mtp -129.9 95.13 3.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.583 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.693 ' O ' HG23 ' A' ' 51' ' ' THR . 3.1 tmm? -175.36 148.65 0.96 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.053 0.454 . . . . 0.0 111.266 -179.411 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.787 HD23 ' O ' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -114.32 145.7 41.45 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.368 179.694 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.1 mtt-85 -130.88 131.68 44.68 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.004 0.43 . . . . 0.0 111.726 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.606 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -111.48 142.06 44.25 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.361 179.41 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.602 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.6 mm -103.51 150.17 7.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.746 0.308 . . . . 0.0 110.8 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -114.32 134.72 11.92 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.234 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 19.8 mttt -54.33 147.07 14.17 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.75 0.31 . . . . 0.0 110.877 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.739 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.2 p -115.0 -162.98 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.346 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.739 ' H ' HG22 ' A' ' 66' ' ' VAL . 52.1 t0 -178.69 76.58 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.102 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.467 ' OE2' HG11 ' A' ' 81' ' ' VAL . 48.1 mt-10 -53.71 -23.83 12.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.424 -179.393 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 42.3 m -61.93 -15.39 42.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.104 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.5 mmtp -64.02 -45.09 90.48 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.753 0.311 . . . . 0.0 111.067 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.9 mmtt 64.09 95.83 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.893 0.377 . . . . 0.0 110.79 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 26.1 mmt85 -106.54 146.99 29.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.849 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -104.04 145.16 30.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.966 0.413 . . . . 0.0 110.969 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 43.6 p30 -87.6 176.91 7.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.991 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -65.1 -16.97 64.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.357 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -86.43 6.66 29.22 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.518 -179.831 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.16 9.65 86.68 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.759 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.2 m-80 -101.31 161.15 13.83 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.763 0.316 . . . . 0.0 110.775 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -90.51 150.42 21.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.887 0.375 . . . . 0.0 110.927 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.469 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.7 m -140.5 158.72 24.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.167 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.467 HG11 ' OE2' ' A' ' 68' ' ' GLU . 20.4 t -86.72 108.89 20.16 Favored Pre-proline 0 C--N 1.326 -0.45 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 178.462 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.469 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 78.2 Cg_exo -50.23 145.29 20.94 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.111 1.874 . . . . 0.0 112.466 -178.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.466 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 7.4 mtpt -110.66 151.56 42.9 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.054 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 15.1 Cg_exo -73.41 155.03 50.98 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 C-N-CA 123.589 2.859 . . . . 0.0 112.642 -178.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -87.13 155.35 20.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.413 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 18.4 ttp180 -141.79 119.72 11.97 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.749 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 4.9 m80 -94.64 136.33 35.06 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.221 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -120.48 112.14 18.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.914 0.388 . . . . 0.0 111.541 -179.5 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.753 ' CD2' HD11 ' A' ' 16' ' ' ILE . 86.4 m-85 -118.12 125.19 49.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.156 179.16 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -95.06 128.8 42.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.968 0.413 . . . . 0.0 111.236 -179.502 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.669 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 75.2 m-85 -113.44 145.55 40.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.81 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -107.75 25.3 11.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.911 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.52 ' HB3' HG23 ' A' ' 96' ' ' VAL . 0.5 OUTLIER -151.91 108.6 3.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.519 179.772 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 24.3 mtm-85 -52.0 -29.38 20.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.231 -179.671 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.12 -54.99 5.83 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.464 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.52 HG23 ' HB3' ' A' ' 93' ' ' ASN . 46.0 t -54.25 -47.14 68.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.813 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.5 ' HB2' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -61.39 -34.36 75.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.964 0.412 . . . . 0.0 110.21 179.337 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.427 ' O ' ' HB3' ' A' ' 102' ' ' MET . 50.6 t0 -63.63 -33.61 76.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.78 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 38.2 m-80 -67.45 -36.96 82.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.168 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.525 HD12 ' CG2' ' A' ' 16' ' ' ILE . 22.8 mm -66.31 -49.22 77.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.739 179.66 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.525 ' HB2' HD11 ' A' ' 48' ' ' LEU . 0.3 OUTLIER -65.27 -27.52 68.69 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.726 179.989 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.427 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -78.71 -40.91 32.36 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.165 179.654 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.437 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -74.23 -39.6 62.96 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.755 -179.898 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.71 ' HA ' HD12 ' A' ' 107' ' ' ILE . 13.2 mt -62.01 -41.03 97.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.714 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.77 ' HA ' HD12 ' A' ' 108' ' ' ILE . 6.1 mt-30 -62.95 -27.28 69.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.994 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -70.47 -32.01 69.37 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.96 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.055 HD13 HD13 ' A' ' 42' ' ' LEU . 5.8 mt -75.93 -46.19 35.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.504 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.77 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.0 mt -56.67 -61.34 1.25 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.585 0 CA-C-O 121.742 0.782 . . . . 0.0 109.635 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 11.5 t -51.0 -28.8 10.74 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.43 -1.259 . . . . 0.0 110.373 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.37 -40.13 95.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.344 179.411 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -84.14 -29.81 26.39 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.28 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.487 ' HE2' HG22 ' A' ' 108' ' ' ILE . 9.7 mttm . . . . . 0 C--N 1.332 -0.193 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.496 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.5 p . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.691 0.282 . . . . 0.0 111.377 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.422 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 74.5 m80 -153.03 36.0 0.48 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.154 0.502 . . . . 0.0 110.917 -179.71 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.476 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 11.7 p -175.04 134.21 0.33 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.649 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -162.2 119.29 0.87 Allowed Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.417 179.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.648 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -43.86 106.12 0.06 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.204 0.526 . . . . 0.0 111.298 -179.612 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.741 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -120.15 152.08 38.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.916 -178.862 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.541 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -100.1 124.79 53.78 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.252 0 CA-C-O 120.959 0.409 . . . . 0.0 110.241 178.876 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.507 ' HB3' ' CZ3' ' A' ' 29' ' ' TRP . 27.3 t80 -112.25 130.43 55.93 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.19 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.427 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 88.9 mt-10 55.24 34.83 23.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.906 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.9 mtpt 76.1 1.3 3.43 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.353 -179.096 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.528 ' O ' HG23 ' A' ' 8' ' ' ILE . 41.4 t -99.38 154.98 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.643 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.881 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.541 ' HA ' HG13 ' A' ' 8' ' ' ILE . 90.4 p -96.65 148.96 22.33 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-O 121.562 0.696 . . . . 0.0 112.595 -178.691 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.447 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.31 -179.68 46.39 Favored Glycine 0 N--CA 1.445 -0.749 0 CA-C-N 114.569 -1.196 . . . . 0.0 110.181 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.648 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.9 143.19 18.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 117.632 0.716 . . . . 0.0 110.637 179.47 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.823 HG12 HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -106.76 118.63 54.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 179.571 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -119.03 129.13 54.95 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.168 0.508 . . . . 0.0 111.409 -178.556 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.48 HD12 ' CG2' ' A' ' 103' ' ' THR . 54.0 mt -102.9 140.07 22.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.934 -179.324 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 47.2 t-20 -132.48 111.42 11.26 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.913 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -93.23 4.64 53.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.247 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -78.95 -17.55 55.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.004 0.43 . . . . 0.0 110.437 179.285 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.64 140.75 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.92 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.443 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.5 t -112.94 116.93 46.93 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.767 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.443 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 1.1 Cg_endo -81.5 142.68 55.46 Favored 'Cis proline' 0 C--N 1.347 0.493 0 C-N-CA 123.878 -1.301 . . . . 0.0 112.054 0.082 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.58 142.85 5.53 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.88 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 72.9 mt-10 -136.03 167.19 21.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.126 0.489 . . . . 0.0 111.552 -179.58 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.823 HD21 HG12 ' A' ' 16' ' ' ILE . 5.3 tt -121.15 129.14 53.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.854 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.5 m -117.05 127.64 54.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.105 0.479 . . . . 0.0 112.011 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.507 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 57.0 t90 -100.57 130.05 46.58 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.111 179.151 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.5 ttt180 -124.97 116.29 21.93 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.938 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.447 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 10.6 m -45.45 163.85 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.042 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.88 -41.5 67.94 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 121.497 0.665 . . . . 0.0 109.551 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.2 t0 -83.3 -20.74 33.86 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.046 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.26 34.3 12.66 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.34 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -100.99 -21.24 15.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.572 0.225 . . . . 0.0 111.505 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.41 144.23 46.41 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.931 0.396 . . . . 0.0 111.329 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 11.7 p -139.4 137.76 40.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.011 179.374 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.498 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 13.6 t60 -132.31 145.53 51.34 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.859 0.361 . . . . 0.0 111.169 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 45.2 m -129.16 135.58 49.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.998 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.4 t -130.07 140.95 47.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.007 0.432 . . . . 0.0 111.642 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.51 ' CG1' HG23 ' A' ' 44' ' ' THR . 7.0 p -87.99 117.47 31.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.367 178.364 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.948 HD13 ' CD1' ' A' ' 107' ' ' ILE . 18.7 mt -76.02 -33.26 59.66 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -178.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.402 ' CB ' ' HB3' ' A' ' 24' ' ' PRO . 39.4 t -57.18 -19.69 22.16 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.495 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.51 HG23 ' CG1' ' A' ' 41' ' ' VAL . 0.2 OUTLIER -101.58 -22.45 14.48 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.346 -179.614 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.573 HD12 ' HB3' ' A' ' 62' ' ' LEU . 39.8 mm -47.87 95.19 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.047 0.451 . . . . 0.0 110.999 -179.673 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -66.73 -26.77 67.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.625 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.766 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 19.1 mttm -148.14 152.6 37.57 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.149 0.5 . . . . 0.0 111.942 -179.227 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.551 HD22 ' N ' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -133.95 128.53 34.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.613 179.178 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -133.58 152.83 51.97 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.067 0.46 . . . . 0.0 111.437 -179.109 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -148.08 153.19 38.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.729 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 37.4 p -75.8 118.82 73.88 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.548 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -64.1 159.11 44.4 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.491 2.127 . . . . 0.0 112.565 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.93 -41.52 98.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.087 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.7 t -57.92 -27.48 63.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.845 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.9 t -85.97 117.91 25.12 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.83 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -57.15 -18.28 14.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.532 179.338 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.0 mmtm -74.94 140.54 43.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.935 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.402 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 10.7 mmm -120.44 115.47 23.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.444 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.64 169.13 1.72 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.112 0.482 . . . . 0.0 111.839 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.419 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -145.73 134.07 21.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.982 179.519 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.2 mtt180 -125.45 133.1 52.57 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.072 0.463 . . . . 0.0 112.138 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.573 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -112.97 131.23 55.84 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.128 179.292 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.766 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.2 mm -99.75 149.99 5.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.77 0.319 . . . . 0.0 111.069 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -120.53 137.74 12.33 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.37 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 24.0 mttp -53.7 141.92 24.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.871 0.367 . . . . 0.0 111.118 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.759 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.4 p -119.57 -161.52 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.799 179.793 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.759 ' H ' HG22 ' A' ' 66' ' ' VAL . 23.8 t0 -165.76 58.94 0.11 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.399 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -57.78 -22.41 46.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.253 -179.552 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 40.8 m -61.24 -16.62 47.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.959 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.4 mtmt -74.45 -35.83 63.34 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.087 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.1 mttt 61.96 93.63 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.684 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 25.8 mmt85 -95.79 141.41 29.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.103 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 43.8 mmtt -89.9 145.64 24.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.956 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -93.07 172.21 8.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.839 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -60.32 -19.97 57.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.185 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -86.29 4.29 39.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.405 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.92 15.25 81.43 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.676 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -111.39 144.68 40.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.923 0.392 . . . . 0.0 110.967 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -70.73 148.99 47.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.038 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.46 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.4 m -134.17 158.94 42.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.03 179.815 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 33.6 t -100.23 98.99 8.54 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.103 -0.498 . . . . 0.0 109.781 178.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.46 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 85.3 Cg_exo -40.07 148.14 0.18 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.721 2.281 . . . . 0.0 113.034 -179.02 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.513 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -115.72 107.35 48.68 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.012 -179.938 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.58 ' HD3' HG21 ' A' ' 66' ' ' VAL . 1.8 Cg_endo -39.09 141.88 0.37 Allowed 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 123.543 2.829 . . . . 0.0 112.585 179.371 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 59.7 mm-40 -65.48 126.34 27.97 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.773 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -122.48 120.42 33.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.931 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.437 ' HB3' ' CE2' ' A' ' 89' ' ' PHE . 94.0 m-70 -98.57 139.23 34.6 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.578 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -121.53 107.86 12.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.256 -179.644 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.597 ' CD1' HD11 ' A' ' 16' ' ' ILE . 95.5 m-85 -114.94 125.43 53.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.462 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.02 136.15 35.69 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.019 0.437 . . . . 0.0 111.136 -179.57 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.741 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 92.5 m-85 -123.69 158.69 31.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.844 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.402 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 68.8 m-20 -115.56 -19.81 10.44 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.405 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -107.33 114.64 28.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.797 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 9.8 mtt85 -57.83 -29.22 64.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.07 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -77.02 -55.15 5.71 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.361 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.6 t -56.85 -45.29 83.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.934 0.397 . . . . 0.0 110.675 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.411 ' HB3' ' CB ' ' A' ' 91' ' ' PHE . 3.9 ppp? -63.84 -36.81 85.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.053 179.142 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -62.52 -33.3 74.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.446 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -67.18 -33.73 76.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.987 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.543 HG22 HD12 ' A' ' 104' ' ' LEU . 17.5 mm -69.83 -48.71 62.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.642 179.346 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.428 ' HA ' HD11 ' A' ' 48' ' ' LEU . 8.5 ptpt -64.4 -27.72 69.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.849 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.7 -41.2 31.7 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.447 179.713 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.48 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -77.21 -30.85 54.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.691 179.876 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.682 ' CD2' HD22 ' A' ' 42' ' ' LEU . 13.5 mt -71.07 -38.63 72.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.788 179.786 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.722 ' HA ' HD12 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -68.4 -29.24 67.88 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.568 179.792 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -71.28 -33.59 69.89 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.709 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.948 ' CD1' HD13 ' A' ' 42' ' ' LEU . 16.3 mt -70.2 -47.96 64.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.016 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.935 HG22 ' CD ' ' A' ' 112' ' ' LYS . 2.7 mt -57.79 -61.07 1.46 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.631 0 CA-C-O 121.862 0.839 . . . . 0.0 109.224 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 27.3 m -50.2 -28.81 8.15 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.376 179.1 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -65.11 -35.31 80.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.785 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.4 ' CZ ' ' HB2' ' A' ' 43' ' ' SER . 69.1 m-85 -89.53 -31.09 17.79 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.04 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.935 ' CD ' HG22 ' A' ' 108' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.586 179.615 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.6 p . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.858 0.361 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.405 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 33.3 m80 65.15 32.97 9.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.229 0.537 . . . . 0.0 111.204 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.562 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 72.6 p 177.65 142.72 0.09 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.665 179.158 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -177.88 114.48 0.46 Allowed Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.327 179.811 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.649 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -44.72 100.12 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.204 0.526 . . . . 0.0 111.327 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.845 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -115.71 152.03 33.98 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.066 -178.897 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.567 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -97.7 124.04 50.45 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.193 178.922 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.523 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 18.7 t80 -112.03 130.31 55.91 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.186 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.425 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 38.9 mt-10 56.07 34.92 24.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.872 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 mtpm? 76.18 0.67 3.31 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.25 -178.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.526 ' O ' HG23 ' A' ' 8' ' ' ILE . 41.3 t -99.92 155.41 4.18 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.713 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.784 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.567 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -96.87 149.86 21.39 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 121.379 0.609 . . . . 0.0 112.48 -178.75 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.453 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 174.83 -179.76 45.93 Favored Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.511 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.649 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.96 141.11 22.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 117.68 0.74 . . . . 0.0 110.457 179.307 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.662 HD11 ' CE1' ' A' ' 89' ' ' PHE . 0.1 OUTLIER -106.71 118.31 54.2 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 CA-C-N 115.312 -0.858 . . . . 0.0 108.685 179.737 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.436 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -119.75 138.57 53.24 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.201 -178.605 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.515 HG21 HD11 ' A' ' 107' ' ' ILE . 96.4 mt -112.78 140.08 34.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.327 -178.872 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -127.08 114.01 17.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.903 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -86.86 5.85 34.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.279 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -79.36 -17.54 54.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.868 0.366 . . . . 0.0 110.426 179.375 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.02 152.0 5.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.984 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.425 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.2 t -129.73 114.74 17.94 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.883 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.425 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 57.5 Cg_endo -72.82 147.25 89.05 Favored 'Cis proline' 0 C--N 1.349 0.578 0 C-N-CA 123.296 -1.543 . . . . 0.0 111.955 0.121 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.713 ' O ' HD22 ' A' ' 42' ' ' LEU . . . -45.44 136.85 5.27 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.557 179.631 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -116.95 152.94 33.51 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.376 0.608 . . . . 0.0 112.03 -178.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.895 ' CB ' HD11 ' A' ' 42' ' ' LEU . 2.9 tt -121.3 130.6 53.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.147 179.166 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.9 m -120.52 127.33 52.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.159 0.504 . . . . 0.0 112.049 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.523 ' CH2' ' HB3' ' A' ' 9' ' ' PHE . 60.6 t90 -100.56 126.77 47.04 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.706 179.044 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 38.1 ttt180 -121.35 116.56 25.04 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.854 0.359 . . . . 0.0 110.875 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.466 ' HG ' ' H ' ' A' ' 36' ' ' LYS . 0.9 OUTLIER -45.48 166.92 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.083 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.87 -42.04 61.34 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 121.541 0.686 . . . . 0.0 109.702 179.657 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -82.69 -20.68 35.65 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.837 -1.074 . . . . 0.0 111.121 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.47 34.4 12.05 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.292 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -103.9 -19.71 14.15 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 -179.588 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.466 ' H ' ' HG ' ' A' ' 31' ' ' SER . 0.0 OUTLIER -135.06 144.04 47.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.892 0.377 . . . . 0.0 111.372 -179.855 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 47.5 t -139.52 140.04 37.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.037 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.497 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 31.6 t-80 -134.33 146.22 49.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.052 179.704 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.439 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 46.4 m -129.15 135.91 49.49 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.337 -179.72 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 84.7 t -139.24 140.54 37.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 CA-C-O 121.066 0.46 . . . . 0.0 111.645 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.637 HG22 HG23 ' A' ' 44' ' ' THR . 1.9 p -88.31 117.6 32.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 177.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.895 HD11 ' CB ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -74.28 -35.91 63.76 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -178.277 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.401 ' CB ' ' HB2' ' A' ' 24' ' ' PRO . 8.3 m -50.04 -25.94 3.88 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -178.998 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.637 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -87.17 -23.52 24.78 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.167 -179.668 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.829 HD12 ' HB3' ' A' ' 62' ' ' LEU . 44.3 mm -50.05 96.66 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.129 0.49 . . . . 0.0 110.917 -179.781 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.423 ' N ' ' O ' ' A' ' 63' ' ' ILE . 16.7 t0 -72.44 -22.93 61.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.954 -179.232 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.452 ' HB2' HG13 ' A' ' 63' ' ' ILE . 43.4 mttm -157.27 137.91 13.12 Favored 'General case' 0 CA--C 1.522 -0.133 0 C-N-CA 120.422 -0.511 . . . . 0.0 111.949 -179.449 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.629 HD21 HD13 ' A' ' 104' ' ' LEU . 15.3 mt -106.34 124.04 48.99 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.903 178.923 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 91.9 mm-40 -115.51 133.26 56.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.801 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.428 ' HB2' HD11 ' A' ' 60' ' ' LEU . . . -142.99 146.34 33.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.057 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.676 HG23 ' O ' ' A' ' 59' ' ' MET . 74.9 p -75.63 130.56 78.94 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.687 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -67.02 160.21 48.35 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.49 2.127 . . . . 0.0 112.519 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.07 -42.87 95.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.02 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 87.1 p -60.63 -26.47 67.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.773 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.6 m -77.36 120.16 21.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.861 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -56.98 -18.1 12.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.409 179.225 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -67.28 155.96 37.57 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.956 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.418 ' HE1' ' O ' ' A' ' 92' ' ' ASN . 44.0 mtp -142.96 80.5 1.69 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.725 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.676 ' O ' HG23 ' A' ' 51' ' ' THR . 10.4 tmm? -162.35 149.37 13.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.453 -179.629 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.428 HD11 ' HB2' ' A' ' 50' ' ' ALA . 0.2 OUTLIER -116.35 152.98 32.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.479 179.771 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -137.91 135.41 36.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.995 0.426 . . . . 0.0 111.886 -179.549 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.829 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -103.53 144.24 31.68 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.384 179.501 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.452 HG13 ' HB2' ' A' ' 47' ' ' LYS . 1.2 mm -116.47 122.65 70.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.059 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.63 151.92 20.56 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.415 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.8 mttt -70.47 136.41 49.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.845 0.355 . . . . 0.0 111.001 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.488 ' CG2' ' N ' ' A' ' 67' ' ' ASP . 1.4 p -70.15 160.51 5.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.299 0.571 . . . . 0.0 111.312 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.488 ' N ' ' CG2' ' A' ' 66' ' ' VAL . 0.5 OUTLIER -113.18 130.69 56.13 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.784 179.901 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -95.0 3.63 54.71 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.453 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 24.0 t -72.08 -9.99 59.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.326 -179.782 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.71 -69.1 0.77 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.757 0.313 . . . . 0.0 111.176 -179.758 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.6 mmtt 62.47 94.23 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.788 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 16.6 mtt-85 -108.17 153.13 23.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.037 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.5 mmtp -93.28 147.73 22.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.986 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -90.47 176.71 6.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.005 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -63.75 -18.67 64.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.272 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -88.57 -5.89 57.9 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.344 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 91.88 9.52 62.4 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.711 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 -105.95 145.15 31.67 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.892 0.377 . . . . 0.0 110.965 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -72.3 144.08 48.48 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.915 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.44 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.3 m -132.3 158.82 43.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.175 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 32.5 t -101.5 98.8 9.95 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.678 178.757 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.44 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 99.2 Cg_exo -42.0 158.54 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.597 2.198 . . . . 0.0 112.743 -179.113 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.447 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.1 OUTLIER -69.86 149.96 96.51 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-O 121.115 0.483 . . . . 0.0 111.055 -179.874 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 16.8 Cg_exo -72.34 164.14 36.52 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 123.473 2.782 . . . . 0.0 112.622 -179.073 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 -65.55 157.36 29.93 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.692 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 62.3 mtm180 -150.11 119.82 7.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.799 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.433 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 36.2 m-70 -105.32 159.06 16.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.465 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -126.67 144.6 50.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.213 0.53 . . . . 0.0 111.681 -179.503 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.662 ' CE1' HD11 ' A' ' 16' ' ' ILE . 97.7 m-85 -157.51 125.21 5.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.119 179.406 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 22.6 t -109.36 139.86 43.79 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.899 0.381 . . . . 0.0 111.387 -179.444 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.845 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 0.8 OUTLIER -126.76 146.57 50.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.521 179.681 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.418 ' O ' ' HE1' ' A' ' 58' ' ' MET . 10.9 m120 -87.21 -18.04 31.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.312 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.461 ' HB2' HG23 ' A' ' 96' ' ' VAL . 94.8 m-20 -109.43 119.43 39.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.819 0.343 . . . . 0.0 110.741 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.62 -31.83 66.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.986 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.91 -46.73 73.92 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.168 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.461 HG23 ' HB2' ' A' ' 93' ' ' ASN . 48.3 t -59.86 -34.2 55.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.484 179.788 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.478 ' HG2' ' CG ' ' A' ' 91' ' ' PHE . 0.2 OUTLIER -63.59 -37.55 87.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.523 179.568 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -71.06 -36.61 72.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.86 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -60.22 -47.39 86.16 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.762 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.524 HG22 HD12 ' A' ' 104' ' ' LEU . 24.5 mm -65.46 -48.98 80.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.888 179.688 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.23 -27.61 68.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.898 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 44.6 mtm -78.65 -37.79 41.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.466 179.632 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.485 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -79.43 -38.97 33.49 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.744 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.629 HD13 HD21 ' A' ' 48' ' ' LEU . 30.2 mt -64.7 -39.62 93.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.591 179.761 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.593 ' HA ' HD12 ' A' ' 108' ' ' ILE . 48.3 mt-30 -61.92 -31.09 71.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.519 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -68.52 -35.45 77.49 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.666 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.664 HG21 ' HB2' ' A' ' 42' ' ' LEU . 58.2 mt -68.22 -48.49 73.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.957 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.807 HG22 ' HD3' ' A' ' 112' ' ' LYS . 2.7 mt -59.93 -61.07 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.508 -0.668 0 CA-C-O 121.663 0.744 . . . . 0.0 109.06 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.5 m -49.74 -28.94 6.81 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.248 -1.342 . . . . 0.0 110.81 179.186 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 31.3 mtt-85 -66.97 -34.8 78.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.707 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -96.41 -30.62 13.27 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.888 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.807 ' HD3' HG22 ' A' ' 108' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.626 179.693 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.0 m . . . . . 0 C--O 1.23 0.065 0 CA-C-O 120.714 0.292 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.412 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 78.0 m80 -137.9 34.02 2.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.174 0.511 . . . . 0.0 110.828 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.521 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 49.9 p 179.97 120.43 0.06 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.709 179.103 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.417 ' O ' ' C ' ' A' ' 6' ' ' ALA . . . -147.4 115.75 0.79 Allowed Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.781 -0.723 . . . . 0.0 111.963 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.554 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -34.2 118.68 0.39 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.794 0.33 . . . . 0.0 111.116 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.583 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -133.46 150.98 51.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.075 -178.734 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.613 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.4 mp -99.83 124.57 53.31 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 CA-C-O 121.157 0.503 . . . . 0.0 110.521 179.227 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.504 ' HB3' ' CZ3' ' A' ' 29' ' ' TRP . 18.2 t80 -116.62 132.53 56.66 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.033 179.847 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.426 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 89.7 mt-10 57.41 33.48 23.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.741 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.5 mttm 75.29 1.24 3.65 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.001 -178.847 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.483 ' O ' HG23 ' A' ' 8' ' ' ILE . 25.0 t -101.0 144.37 12.94 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.769 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.752 179.078 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.613 ' HA ' HG13 ' A' ' 8' ' ' ILE . 81.0 p -83.72 145.6 28.65 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.278 -179.568 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.442 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . -174.3 -179.12 44.71 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.844 -179.377 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.554 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 4.5 mm -105.37 135.27 44.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-O 120.914 0.388 . . . . 0.0 110.373 179.74 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.583 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.2 OUTLIER -106.44 118.01 53.3 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.884 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 178.634 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.459 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -122.08 128.69 51.63 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.345 0.593 . . . . 0.0 111.84 -177.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.412 ' O ' ' HB3' ' A' ' 3' ' ' HIS . 59.8 mt -101.77 140.01 21.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.787 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.461 ' ND2' HG21 ' A' ' 22' ' ' VAL . 50.2 p-10 -131.27 111.47 11.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.999 0.428 . . . . 0.0 111.168 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -92.4 4.01 54.29 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.419 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -78.35 -17.71 56.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.962 0.41 . . . . 0.0 110.414 179.332 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.461 HG21 ' ND2' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -100.88 151.32 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.015 -179.719 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.44 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.1 t -123.67 117.56 27.53 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.642 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.453 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 1.6 Cg_endo -79.74 145.65 73.81 Favored 'Cis proline' 0 C--N 1.348 0.517 0 C-N-CA 123.678 -1.384 . . . . 0.0 112.044 0.008 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.21 145.86 2.11 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.714 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -137.41 167.05 22.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.307 0.575 . . . . 0.0 111.983 -179.126 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.592 ' C ' HD23 ' A' ' 27' ' ' LEU . 5.4 tt -125.86 124.67 41.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.388 179.2 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.5 m -116.69 130.53 56.79 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.147 0.499 . . . . 0.0 112.056 -178.711 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.504 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 58.7 t90 -100.63 129.01 46.49 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.241 179.096 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 45.4 ttt-85 -127.75 116.99 21.07 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.504 179.562 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.401 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 14.5 m -44.66 155.96 0.09 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.952 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.42 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -65.4 -39.35 92.07 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.638 0.732 . . . . 0.0 109.25 179.978 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -85.03 -23.1 28.76 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 114.68 -1.146 . . . . 0.0 111.129 179.886 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.85 32.06 10.43 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.601 179.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -94.71 -21.86 18.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.592 0.234 . . . . 0.0 111.48 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.47 147.02 44.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.902 0.382 . . . . 0.0 111.17 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 14.7 p -139.13 138.14 41.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.126 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -136.44 145.87 45.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.984 0.421 . . . . 0.0 111.173 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 40.3 m -129.2 137.25 51.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.998 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 88.2 t -134.1 140.85 45.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 121.186 0.517 . . . . 0.0 111.754 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.598 HG22 HG23 ' A' ' 44' ' ' THR . 1.7 p -87.95 117.77 32.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 178.024 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.998 HD13 HD13 ' A' ' 107' ' ' ILE . 58.2 mt -75.21 -29.66 60.39 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -178.607 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.453 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 8.1 t -55.86 -22.16 23.76 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.109 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.598 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -94.8 -21.63 18.59 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.137 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.868 HD12 ' HB3' ' A' ' 62' ' ' LEU . 39.3 mm -57.95 88.26 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.983 0.421 . . . . 0.0 110.922 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -70.04 -29.06 66.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.383 -179.527 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.68 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 18.2 mttm -138.99 142.36 38.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.969 0.414 . . . . 0.0 111.575 -179.294 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.722 HD23 ' HG2' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -124.71 124.41 42.11 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.609 179.134 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -116.82 139.32 50.74 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.049 -179.205 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.509 ' HB3' ' CE ' ' A' ' 101' ' ' LYS . . . -143.39 144.22 31.96 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.969 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 32.3 p -75.65 113.44 26.67 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.548 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.46 160.57 35.02 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.545 2.164 . . . . 0.0 112.643 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.01 -42.97 77.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.243 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.5 m -58.29 -27.63 64.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.725 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 23.4 t -85.06 118.2 24.49 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.891 179.778 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -56.22 -18.7 11.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.583 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -65.44 159.03 25.18 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.871 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.438 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 26.8 mtp -142.92 79.92 1.67 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.819 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 29.3 mtm -154.7 169.09 24.72 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.152 0.501 . . . . 0.0 111.633 -179.671 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.453 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -140.79 123.88 16.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.529 -0.759 . . . . 0.0 109.955 179.502 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 47.1 ttt180 -113.43 137.11 52.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.853 0.358 . . . . 0.0 111.789 -179.258 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.868 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -112.61 144.08 42.71 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.624 179.749 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.68 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 2.0 mm -114.79 124.32 71.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.025 179.582 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -90.37 129.93 9.99 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.466 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 48.3 mttt -45.9 152.43 0.37 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.738 0.304 . . . . 0.0 111.284 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.704 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.0 OUTLIER -122.23 -162.89 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.865 -179.944 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.704 ' H ' HG22 ' A' ' 66' ' ' VAL . 9.7 t0 179.67 51.52 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.402 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.598 ' OE2' HG12 ' A' ' 81' ' ' VAL . 50.8 mt-10 -57.5 -22.3 43.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.402 -179.57 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.9 m -63.89 -14.26 52.01 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.135 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.2 mtmt -70.14 -45.47 66.75 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.846 0.355 . . . . 0.0 111.307 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.1 mttm 61.42 93.31 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.672 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.83 151.44 25.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.001 -179.794 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.6 mmtm -86.16 145.44 27.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.076 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 43.7 p30 -95.77 177.45 5.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.896 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -60.28 -19.98 57.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.337 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -88.45 9.75 22.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.513 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 70.31 17.86 74.6 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.696 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 35.2 m120 -115.52 145.87 42.23 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.862 0.363 . . . . 0.0 110.754 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 55.7 mp0 -74.56 142.5 44.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.97 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.478 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.0 m -131.36 158.88 43.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.01 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.598 HG12 ' OE2' ' A' ' 68' ' ' GLU . 15.4 t -102.29 98.52 10.67 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.712 178.778 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.478 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 87.2 Cg_exo -45.83 163.49 0.09 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.493 2.129 . . . . 0.0 112.578 -179.089 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.462 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 21.5 mtpp -117.99 147.74 41.96 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.97 0.414 . . . . 0.0 110.991 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 16.5 Cg_exo -72.7 136.27 25.29 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 123.363 2.708 . . . . 0.0 112.665 -179.045 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 40.0 mm-40 -67.01 149.32 50.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.72 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.2 mtp85 -151.59 120.0 6.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.747 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -104.59 144.94 31.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.769 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.4 ttt -122.94 118.34 27.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.887 0.375 . . . . 0.0 111.224 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.492 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 93.7 m-85 -124.98 141.94 51.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.521 179.713 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 1.3 p -114.0 135.67 53.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.899 0.38 . . . . 0.0 111.054 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.496 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 23.8 m-85 -122.47 156.48 34.01 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.75 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.438 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 57.6 m-20 -118.78 20.3 12.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.111 179.713 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -147.9 110.2 4.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.844 0.354 . . . . 0.0 110.669 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 15.5 mtt-85 -54.46 -29.33 49.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.066 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -75.79 -55.04 6.01 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.356 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 46.6 t -56.08 -47.41 80.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.622 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.5 ppp? -63.06 -35.55 80.62 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.84 179.135 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -61.12 -35.19 76.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.397 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -67.9 -35.38 78.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.197 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.44 HG22 HD12 ' A' ' 104' ' ' LEU . 18.3 mm -70.73 -52.07 31.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.719 179.41 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.517 ' CG ' HD11 ' A' ' 48' ' ' LEU . 0.6 OUTLIER -61.58 -28.04 69.06 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.862 179.85 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 46.3 mtm -78.46 -40.81 34.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.655 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.15 -31.84 49.96 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.624 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.702 ' HA ' HD12 ' A' ' 107' ' ' ILE . 14.0 mt -65.94 -39.89 90.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.887 0.375 . . . . 0.0 110.661 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.777 ' HA ' HD12 ' A' ' 108' ' ' ILE . 1.4 mt-30 -63.1 -28.43 70.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.037 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -70.25 -36.85 74.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.052 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.998 HD13 HD13 ' A' ' 42' ' ' LEU . 6.0 mt -69.47 -46.98 74.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.356 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.817 HG22 ' CD ' ' A' ' 112' ' ' LYS . 2.3 mt -57.22 -61.11 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.597 0 CA-C-O 121.696 0.76 . . . . 0.0 109.584 179.278 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 29.9 m -51.51 -28.68 14.21 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.458 179.049 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 4.3 mtt-85 -66.27 -35.35 80.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.787 179.661 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.406 ' CZ ' ' HB2' ' A' ' 43' ' ' SER . 79.8 m-85 -93.13 -34.48 13.62 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.954 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.817 ' CD ' HG22 ' A' ' 108' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 CA-C-O 120.982 0.42 . . . . 0.0 110.748 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.742 0.306 . . . . 0.0 111.024 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.458 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 52.3 m80 64.53 29.05 13.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.207 0.527 . . . . 0.0 111.367 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.502 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 0.9 OUTLIER -172.69 139.97 0.96 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.549 179.022 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.402 ' CA ' ' CG1' ' A' ' 96' ' ' VAL . . . -171.49 118.27 0.73 Allowed Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.319 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.647 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -47.84 100.2 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.18 0.514 . . . . 0.0 111.212 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.829 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -114.63 152.19 32.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.914 -178.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.555 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -100.57 123.72 53.68 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.259 0 CA-C-O 120.956 0.408 . . . . 0.0 110.414 178.998 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.502 ' HB3' ' CZ3' ' A' ' 29' ' ' TRP . 14.4 t80 -111.3 131.16 55.37 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.173 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.43 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 37.1 mt-10 54.85 34.94 23.15 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.936 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.5 mttm 75.84 1.78 3.58 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.35 -179.178 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.522 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.9 t -100.04 154.6 4.33 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.69 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 178.834 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.555 ' HA ' HG13 ' A' ' 8' ' ' ILE . 94.4 p -97.01 149.62 21.71 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.674 0.75 . . . . 0.0 112.776 -178.629 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.436 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 174.38 -179.84 45.46 Favored Glycine 0 N--CA 1.447 -0.623 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.241 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.647 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -107.15 141.93 21.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 117.801 0.801 . . . . 0.0 110.583 179.407 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.88 HG12 HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -106.73 118.43 54.44 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 CA-C-N 115.283 -0.871 . . . . 0.0 108.653 179.527 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.468 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -120.53 131.2 54.58 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.223 0.535 . . . . 0.0 111.213 -178.717 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.646 HG23 HD11 ' A' ' 42' ' ' LEU . 76.9 mt -103.25 140.22 22.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.207 -179.08 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -131.54 111.46 11.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.882 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -90.61 6.35 44.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.214 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -79.28 -17.88 53.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.9 0.381 . . . . 0.0 110.448 179.3 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -100.25 143.04 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.095 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.446 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.0 t -115.33 116.47 41.79 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.722 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.459 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 1.5 Cg_endo -80.8 143.24 61.68 Favored 'Cis proline' 0 C--N 1.348 0.525 0 C-N-CA 123.816 -1.327 . . . . 0.0 111.956 -0.013 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.26 142.42 2.91 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.053 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -135.61 167.3 21.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.191 0.519 . . . . 0.0 111.57 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.88 HD21 HG12 ' A' ' 16' ' ' ILE . 4.8 tt -121.04 130.94 53.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.806 179.595 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 48.0 m -117.74 126.01 51.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.199 0.524 . . . . 0.0 112.074 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.502 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 56.9 t90 -100.58 129.09 46.47 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.075 179.07 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 26.2 ttt85 -123.94 117.57 25.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.91 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.413 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 17.9 t -45.51 166.53 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.102 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.77 -42.64 57.81 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-O 121.452 0.644 . . . . 0.0 109.62 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -86.46 -16.62 36.54 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.079 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.8 34.24 13.82 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.238 -179.796 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -97.75 -21.62 16.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.573 0.225 . . . . 0.0 111.6 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.458 ' NZ ' HG21 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -138.99 146.76 41.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.027 0.442 . . . . 0.0 111.597 -179.892 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 47.5 t -139.56 140.49 36.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.769 179.293 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.5 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 38.1 t60 -135.55 145.58 47.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.023 0.44 . . . . 0.0 111.321 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 47.7 m -129.32 135.27 48.52 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.86 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.4 t -130.84 140.89 47.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 121.142 0.496 . . . . 0.0 111.612 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.623 HG22 HG23 ' A' ' 44' ' ' THR . 2.0 p -86.41 117.78 31.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 178.214 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 1.043 HD13 HD13 ' A' ' 107' ' ' ILE . 66.3 mt -75.39 -30.68 60.21 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.259 -0.428 . . . . 0.0 112.092 -178.618 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.459 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 11.4 t -55.64 -21.88 20.03 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 -178.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.623 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -94.41 -21.57 18.86 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.718 0.294 . . . . 0.0 111.36 -179.673 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.716 HD12 ' HB3' ' A' ' 62' ' ' LEU . 37.3 mm -51.76 92.71 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.97 0.414 . . . . 0.0 111.091 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -66.07 -29.73 70.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.109 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.634 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 18.2 mttp -153.35 158.99 42.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.977 0.418 . . . . 0.0 111.302 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.517 HD23 ' HG3' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -131.66 128.82 39.86 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.948 179.381 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -119.92 144.97 47.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.93 0.395 . . . . 0.0 111.072 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.812 ' HB2' HD12 ' A' ' 60' ' ' LEU . . . -148.06 141.63 25.47 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.033 179.884 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.53 HG21 ' HB3' ' A' ' 57' ' ' LYS . 73.3 p -75.69 117.17 61.6 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.587 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -62.05 160.56 29.57 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.519 2.146 . . . . 0.0 112.564 -179.659 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.67 -43.11 80.08 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.095 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 84.3 p -62.32 -27.48 69.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.053 0.454 . . . . 0.0 110.558 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.4 m -79.72 120.52 24.13 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.844 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.4 tp10 -55.62 -19.02 8.98 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.453 179.066 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.53 ' HB3' HG21 ' A' ' 51' ' ' THR . 0.0 OUTLIER -71.51 141.13 50.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.9 179.859 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 63.5 mtp -131.25 79.81 1.9 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.542 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 38.3 mtm -155.79 169.09 25.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.163 0.506 . . . . 0.0 111.527 -179.449 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.812 HD12 ' HB2' ' A' ' 50' ' ' ALA . 4.7 tp -134.17 124.03 25.34 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.113 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 53.2 ttt180 -112.27 126.53 55.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.938 0.399 . . . . 0.0 111.783 -179.369 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.716 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -105.47 143.7 33.27 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.38 179.423 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.634 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.5 mm -108.78 121.98 62.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.744 0.307 . . . . 0.0 111.174 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -90.5 128.09 9.11 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.206 179.52 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 23.6 mttt -50.04 146.09 5.14 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.879 0.371 . . . . 0.0 111.164 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.737 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.4 p -111.14 -162.15 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.051 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.737 ' H ' HG22 ' A' ' 66' ' ' VAL . 7.2 m-20 -173.03 71.62 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.245 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.453 ' OE2' HG21 ' A' ' 81' ' ' VAL . 49.9 mt-10 -55.73 -22.28 22.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.437 -179.497 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 26.8 t -59.35 -17.48 30.11 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.085 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 62.3 mmtt -64.8 -45.28 86.91 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.794 0.33 . . . . 0.0 111.025 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.3 mptt 61.63 94.08 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.747 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.404 ' CG ' ' HG3' ' A' ' 82' ' ' PRO . 26.2 mmt180 -90.74 165.77 13.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.888 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.8 mttp -125.54 147.4 49.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.129 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -78.35 172.43 13.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.746 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -57.67 -24.0 54.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.227 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 48.8 mp0 -95.1 19.59 10.27 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.28 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.52 9.23 84.62 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.901 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -67.3 -163.5 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.696 0.284 . . . . 0.0 110.799 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -137.95 138.19 38.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.715 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.482 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 1.8 m -140.62 156.32 23.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.221 0.534 . . . . 0.0 111.376 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.477 HG13 ' O ' ' A' ' 81' ' ' VAL . 3.0 p -99.12 98.96 7.16 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 114.993 -1.003 . . . . 0.0 109.916 179.257 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.482 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 96.8 Cg_exo -41.9 145.32 0.77 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.663 2.242 . . . . 0.0 112.853 -178.969 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.451 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 3.4 mmpt? -94.45 153.12 40.44 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.995 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 19.0 Cg_exo -71.55 141.65 38.67 Favored 'Trans proline' 0 N--CA 1.466 -0.133 0 C-N-CA 123.406 2.737 . . . . 0.0 112.7 -179.01 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -65.55 147.26 53.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.859 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.419 ' HE ' HG23 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -149.63 119.8 7.26 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.668 179.931 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -100.62 156.93 17.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.709 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.8 ttt -133.53 126.82 31.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.237 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.636 ' CE1' HD11 ' A' ' 16' ' ' ILE . 90.2 m-85 -134.22 148.19 50.82 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.518 179.625 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 38.7 t -128.56 133.1 48.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.952 0.406 . . . . 0.0 111.356 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.829 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 0.7 OUTLIER -123.38 160.99 25.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.286 179.679 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 36.1 m-20 -114.3 28.36 8.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.846 0.355 . . . . 0.0 110.876 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.592 ' ND2' HG23 ' A' ' 96' ' ' VAL . 44.9 t-20 -152.7 110.12 3.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.608 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.84 -31.17 37.68 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.016 0.436 . . . . 0.0 110.892 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.61 -54.87 11.91 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.944 179.808 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.592 HG23 ' ND2' ' A' ' 93' ' ' ASN . 50.8 t -58.76 -35.73 57.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.06 0.457 . . . . 0.0 110.332 179.474 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.484 ' HG3' ' CD1' ' A' ' 91' ' ' PHE . 1.7 ttp -66.74 -38.56 86.89 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.641 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.5 ' O ' ' HB3' ' A' ' 102' ' ' MET . 52.0 t0 -69.36 -35.32 75.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.769 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -61.57 -35.64 78.39 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.154 179.562 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.514 HG21 HD22 ' A' ' 60' ' ' LEU . 18.1 mm -71.69 -50.86 36.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.791 179.63 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.485 ' O ' HD21 ' A' ' 48' ' ' LEU . 1.0 OUTLIER -63.24 -27.37 69.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.798 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.5 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.7 OUTLIER -78.51 -41.74 31.52 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.201 179.626 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.603 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -71.92 -40.08 69.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.804 -179.999 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.649 ' HA ' HD12 ' A' ' 107' ' ' ILE . 13.6 mt -61.62 -38.8 88.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.764 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.779 ' HA ' HD12 ' A' ' 108' ' ' ILE . 5.2 mt-30 -63.42 -27.07 69.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.96 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -70.08 -34.07 72.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.124 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.043 HD13 HD13 ' A' ' 42' ' ' LEU . 3.8 mt -74.22 -45.83 46.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.561 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.863 HG22 ' HD3' ' A' ' 112' ' ' LYS . 2.3 mt -56.64 -61.25 1.28 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.542 0 CA-C-O 121.734 0.778 . . . . 0.0 109.5 179.388 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.1 t -49.45 -28.87 5.74 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.783 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 7.2 mtt-85 -67.5 -35.33 78.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.625 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -93.41 -31.88 14.45 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.729 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.863 ' HD3' HG22 ' A' ' 108' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.523 179.676 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.3 m . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.824 0.345 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.418 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 25.3 m80 64.37 30.52 13.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.173 0.511 . . . . 0.0 110.999 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.559 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 88.4 p 174.91 126.69 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.634 178.975 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.419 ' O ' ' C ' ' A' ' 6' ' ' ALA . . . -163.6 110.37 0.42 Allowed Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.868 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.584 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -33.11 116.33 0.23 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.812 0.339 . . . . 0.0 111.261 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.691 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -133.63 151.84 51.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.081 -0.508 . . . . 0.0 112.08 -178.744 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.599 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.0 OUTLIER -97.62 125.12 50.85 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.226 0 CA-C-O 121.062 0.458 . . . . 0.0 110.56 179.203 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.508 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 25.2 t80 -116.65 128.52 55.45 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.912 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.421 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 88.7 mt-10 59.31 33.58 22.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.721 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.7 mttt 75.94 1.87 3.56 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.183 -178.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.501 HG21 ' HE2' ' A' ' 36' ' ' LYS . 35.2 t -101.13 152.07 5.22 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.755 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 178.94 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.599 ' HA ' HG13 ' A' ' 8' ' ' ILE . 83.4 p -90.65 146.0 24.39 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 121.377 0.608 . . . . 0.0 111.518 -179.384 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.444 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -177.07 -179.17 47.31 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.702 -179.565 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.584 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.4 mm -105.21 136.2 40.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 120.859 0.362 . . . . 0.0 110.285 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.872 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.58 117.89 53.23 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 178.934 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.473 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -124.17 133.73 53.49 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.359 -178.118 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.769 HG23 HD11 ' A' ' 42' ' ' LEU . 82.6 mt -105.8 140.0 25.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.353 -179.031 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -131.36 114.81 15.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.841 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -92.83 5.33 51.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.364 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -78.95 -17.97 54.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.035 0.445 . . . . 0.0 110.383 179.262 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.25 143.48 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.866 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.8 m -117.78 119.66 33.69 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.861 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.433 ' HB3' ' HB3' ' A' ' 43' ' ' SER . 3.4 Cg_exo -78.71 141.1 62.53 Favored 'Cis proline' 0 C--N 1.348 0.548 0 C-N-CA 123.621 -1.408 . . . . 0.0 111.786 -0.151 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -43.59 137.68 2.83 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.01 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.409 ' HA ' ' HG ' ' A' ' 42' ' ' LEU . 72.3 mt-10 -130.24 165.04 23.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.159 0.504 . . . . 0.0 111.835 -179.049 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.872 HD21 HG12 ' A' ' 16' ' ' ILE . 7.0 tt -121.12 125.68 47.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.472 179.099 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.6 m -113.29 128.9 56.62 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.559 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.486 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 58.9 t90 -100.56 126.63 47.03 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.931 178.769 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.46 117.81 25.24 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.653 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 29.7 t -44.42 157.29 0.06 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.882 -179.759 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.444 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.2 OUTLIER -65.18 -39.11 92.44 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.624 0.726 . . . . 0.0 109.146 179.863 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 -85.24 -23.95 28.0 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.629 -1.169 . . . . 0.0 111.017 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 91.28 31.69 9.47 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.615 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -100.0 -19.94 16.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.696 0.284 . . . . 0.0 111.437 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.501 ' HE2' HG21 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -131.62 141.49 49.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.825 0.345 . . . . 0.0 111.092 -179.926 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 13.5 p -139.13 135.02 41.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.27 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.508 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 70.8 t60 -135.07 146.32 48.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.201 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 40.0 m -126.58 140.52 52.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.077 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 93.3 t -134.68 140.93 44.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 121.118 0.485 . . . . 0.0 111.698 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.6 HG22 HG23 ' A' ' 44' ' ' THR . 1.5 p -86.02 118.09 31.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.0 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 1.152 HD13 HD13 ' A' ' 107' ' ' ILE . 46.3 mt -74.53 -30.15 61.66 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -178.313 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.433 ' HB3' ' HB3' ' A' ' 24' ' ' PRO . 60.2 p -56.14 -22.06 26.27 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -178.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.6 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -90.82 -24.29 20.34 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.883 0.373 . . . . 0.0 111.331 -179.596 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.955 HD12 ' HB3' ' A' ' 62' ' ' LEU . 42.3 mm -57.78 92.04 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.806 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -80.42 -26.11 38.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.734 -179.343 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.691 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 19.4 mtmt -137.61 152.83 49.79 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.201 0.524 . . . . 0.0 112.049 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.818 HD21 ' HB3' ' A' ' 104' ' ' LEU . 22.2 mt -116.28 124.41 50.11 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.032 179.338 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.406 ' CB ' ' HG3' ' A' ' 61' ' ' ARG . 10.4 mp0 -121.91 130.31 53.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.893 0.378 . . . . 0.0 110.823 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.918 ' HB2' HD12 ' A' ' 60' ' ' LEU . . . -144.66 143.92 30.98 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.965 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.477 HG23 ' O ' ' A' ' 59' ' ' MET . 72.7 p -75.67 123.74 88.52 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.46 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -61.1 154.54 56.57 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.597 2.198 . . . . 0.0 112.537 -179.698 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.17 -42.49 98.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.125 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.6 t -58.07 -27.61 63.8 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.05 0.452 . . . . 0.0 110.831 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.6 t -80.21 119.16 22.6 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.808 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -55.95 -18.65 9.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.521 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.3 mttm -81.4 126.23 31.36 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.94 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.49 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 28.4 mtp -107.93 117.62 34.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.593 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.477 ' O ' HG23 ' A' ' 51' ' ' THR . 1.7 ttm -174.59 167.97 3.79 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.185 0.517 . . . . 0.0 111.791 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.918 HD12 ' HB2' ' A' ' 50' ' ' ALA . 1.6 tp -153.58 138.97 17.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.918 179.824 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.406 ' HG3' ' CB ' ' A' ' 49' ' ' GLN . 0.2 OUTLIER -139.98 148.09 41.39 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.005 0.431 . . . . 0.0 111.869 -179.649 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.955 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -109.47 144.34 37.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.582 179.919 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.691 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 2.5 mm -105.82 121.72 58.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.766 0.317 . . . . 0.0 111.112 179.738 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -86.07 131.39 10.48 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.313 179.54 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.4 mttt -46.34 150.63 0.61 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.702 0.287 . . . . 0.0 111.334 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.7 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.3 p -116.86 -162.09 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.973 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.7 ' H ' HG22 ' A' ' 66' ' ' VAL . 25.9 m-20 -166.29 59.8 0.1 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.324 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.616 ' HB3' HG13 ' A' ' 81' ' ' VAL . 86.7 mt-10 -57.44 -21.5 37.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.411 -179.658 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 32.7 t -58.6 -18.23 28.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.116 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -67.56 -51.43 50.77 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.887 0.375 . . . . 0.0 110.956 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.6 mttt 57.65 88.12 0.06 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.033 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.71 135.33 39.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.811 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 18.1 mmtm -75.24 144.84 42.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.313 -179.64 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -95.23 174.15 7.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.87 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -59.6 -19.88 51.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.324 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 49.3 mp0 -87.66 7.69 28.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.434 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.05 18.59 79.24 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.6 -0.81 . . . . 0.0 112.685 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -115.56 145.51 42.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.746 0.307 . . . . 0.0 111.024 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -76.45 146.32 38.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.897 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.441 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 1.3 m -133.7 158.72 42.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.213 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.616 HG13 ' HB3' ' A' ' 68' ' ' GLU . 16.2 t -103.55 98.68 13.21 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.724 178.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.441 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 87.4 Cg_exo -46.13 145.52 5.32 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 122.448 2.099 . . . . 0.0 112.438 -179.157 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.433 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 2.1 mptt -83.45 143.44 44.53 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.056 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 15.1 Cg_exo -73.55 152.56 48.72 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 123.558 2.839 . . . . 0.0 112.629 -178.998 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -67.2 147.76 52.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.585 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.8 mtp-105 -147.56 120.05 8.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.156 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -99.06 159.05 15.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.402 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 23.1 ttt -133.41 138.94 46.47 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.006 0.431 . . . . 0.0 111.567 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.716 ' CD1' HD11 ' A' ' 16' ' ' ILE . 95.3 m-85 -152.02 125.41 8.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.214 179.643 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.7 t -98.98 133.01 43.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.095 0.474 . . . . 0.0 111.314 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.691 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 80.7 m-85 -120.19 152.71 37.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.629 179.664 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.49 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 16.7 m-20 -108.4 -6.62 16.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.371 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -121.64 108.73 13.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.871 0.367 . . . . 0.0 110.749 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.86 -28.62 3.88 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.112 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -76.28 -54.93 6.06 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.205 -179.694 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 58.9 t -53.42 -47.88 58.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.772 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.411 ' HB3' ' CG ' ' A' ' 91' ' ' PHE . 0.0 OUTLIER -61.4 -35.68 78.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.222 179.473 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 54.5 t0 -64.63 -35.63 81.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.465 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.428 ' O ' ' HB ' ' A' ' 103' ' ' THR . 53.9 m-80 -65.45 -42.93 91.8 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.971 179.228 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.573 HD12 ' CG2' ' A' ' 16' ' ' ILE . 27.4 mm -62.38 -52.15 63.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.573 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.426 ' O ' HD13 ' A' ' 48' ' ' LEU . 6.9 pttp -64.05 -27.87 69.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.657 179.685 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 38.4 mtm -78.84 -40.41 32.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.741 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.451 HG22 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -75.56 -43.52 48.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.016 -179.825 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 1.108 HD21 HD22 ' A' ' 42' ' ' LEU . 3.5 mt -61.43 -33.97 74.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.818 0.342 . . . . 0.0 110.981 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.732 ' HA ' HD12 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -67.85 -26.51 66.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.696 -179.988 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -69.49 -30.1 67.89 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.559 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.152 HD13 HD13 ' A' ' 42' ' ' LEU . 3.9 mt -76.38 -45.37 34.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.244 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.732 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.1 mt -57.87 -61.44 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.63 0 CA-C-O 121.669 0.747 . . . . 0.0 109.516 179.367 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.8 m -51.76 -28.81 16.49 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.284 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 3.9 mtt180 -64.41 -35.35 80.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.524 179.521 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -92.77 -28.86 16.32 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.781 179.81 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.707 ' HD3' HG22 ' A' ' 108' ' ' ILE . 2.0 mptp? . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.75 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.0 m . . . . . 0 CA--C 1.524 -0.033 0 CA-C-O 120.787 0.327 . . . . 0.0 111.07 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.422 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 66.3 m80 -141.35 34.99 1.67 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.136 0.493 . . . . 0.0 110.963 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.49 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 6.2 p -173.32 116.75 0.27 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.877 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -146.57 117.67 0.97 Allowed Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.391 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.638 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -41.38 108.69 0.1 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.178 0.513 . . . . 0.0 111.673 -179.523 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.66 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -122.35 153.04 39.52 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.974 -178.811 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.546 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -100.11 125.53 53.82 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.236 0 CA-C-O 120.956 0.408 . . . . 0.0 110.35 178.881 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.508 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 5.7 t80 -113.1 130.85 56.04 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.134 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 55.4 34.29 22.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.9 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 30.9 mttm 76.28 1.21 3.37 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.322 -179.046 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.518 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.6 t -99.69 154.29 4.27 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.641 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 178.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.546 ' HA ' HG13 ' A' ' 8' ' ' ILE . 90.6 p -95.65 149.2 21.72 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.579 0.704 . . . . 0.0 112.613 -178.671 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.476 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.42 -179.62 46.53 Favored Glycine 0 N--CA 1.446 -0.648 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.347 -179.797 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.638 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.71 142.65 19.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 117.608 0.704 . . . . 0.0 110.68 179.367 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.836 HG12 HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -106.77 118.49 54.62 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.764 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 179.48 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -118.28 123.91 46.55 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.334 -178.698 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.422 ' O ' ' HB3' ' A' ' 3' ' ' HIS . 42.2 mt -96.74 138.46 21.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.995 -179.403 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 65.9 m-20 -131.03 114.2 14.89 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.988 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -91.92 5.93 48.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.169 179.626 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -78.95 -18.13 54.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.957 0.408 . . . . 0.0 110.313 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.78 145.24 10.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.886 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.424 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.0 t -119.44 115.65 33.96 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.967 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.454 ' HG2' HG23 ' A' ' 41' ' ' VAL . 79.7 Cg_endo -78.06 146.3 80.54 Favored 'Cis proline' 0 C--N 1.348 0.53 0 C-N-CA 123.42 -1.492 . . . . 0.0 112.193 0.132 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.63 137.69 8.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.629 179.591 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -127.3 167.05 16.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.153 0.501 . . . . 0.0 111.701 -179.152 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.836 HD21 HG12 ' A' ' 16' ' ' ILE . 5.0 tt -121.16 130.58 53.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.8 179.417 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.3 m -116.6 123.93 48.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.117 0.484 . . . . 0.0 111.907 -179.093 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.49 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 58.5 t90 -100.63 128.93 46.51 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.073 179.311 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 8.5 ttm180 -124.68 116.32 22.18 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.824 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.476 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 28.8 t -45.24 164.13 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.091 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.51 -41.42 65.94 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.498 0.666 . . . . 0.0 109.611 179.655 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -81.13 -22.08 39.32 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.075 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.29 33.25 10.75 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.447 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -107.33 -21.12 13.05 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.658 0.266 . . . . 0.0 111.489 -179.817 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.496 ' NZ ' HG21 ' A' ' 12' ' ' VAL . 7.3 mtmt -127.2 134.41 50.13 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.862 0.363 . . . . 0.0 111.176 -179.852 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.4 t -139.13 136.19 42.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.939 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.508 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 41.5 t-80 -138.81 146.21 41.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.217 0.532 . . . . 0.0 111.387 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 49.6 m -126.09 139.41 53.41 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.893 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 95.8 t -131.77 140.87 47.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.094 0.474 . . . . 0.0 111.637 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.768 HG13 ' CG2' ' A' ' 44' ' ' THR . 1.4 p -85.35 118.06 31.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 178.022 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 1.029 HD13 HD13 ' A' ' 107' ' ' ILE . 61.2 mt -72.38 -30.23 64.49 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.212 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.448 ' CB ' ' HB2' ' A' ' 24' ' ' PRO . 2.3 t -53.91 -23.66 13.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.682 0.277 . . . . 0.0 111.641 -179.516 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.768 ' CG2' HG13 ' A' ' 41' ' ' VAL . 0.2 OUTLIER -84.56 -25.49 28.66 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.137 -179.855 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.622 HD12 ' HB3' ' A' ' 62' ' ' LEU . 45.6 mm -54.33 101.39 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.129 -179.505 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -95.78 -20.66 18.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.54 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.465 ' HB2' HG13 ' A' ' 63' ' ' ILE . 35.8 mttt -153.39 133.43 13.3 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.009 0.433 . . . . 0.0 111.302 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.725 HD11 ' HB3' ' A' ' 104' ' ' LEU . 54.0 mt -105.81 124.28 49.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.632 179.681 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -109.66 130.39 55.52 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.467 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.617 ' HB3' ' HE2' ' A' ' 101' ' ' LYS . . . -142.05 142.07 32.83 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.98 -179.734 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 81.3 p -75.75 137.71 70.09 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.57 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.16 152.95 55.89 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.583 2.189 . . . . 0.0 112.503 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.01 -43.0 99.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.181 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.1 m -58.01 -27.63 63.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.697 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.4 m -82.35 119.99 24.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.795 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -57.2 -18.27 14.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.456 179.155 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 32.0 mmtt -58.46 134.49 56.71 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.045 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.467 ' HE3' ' HB3' ' A' ' 58' ' ' MET . 30.5 mmm -122.15 100.56 7.03 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.48 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -174.81 145.15 0.85 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.008 0.432 . . . . 0.0 111.784 -179.659 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.619 HD11 ' HB2' ' A' ' 101' ' ' LYS . 2.5 tt -126.22 131.46 51.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.107 179.388 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.79 124.05 51.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.96 0.41 . . . . 0.0 111.959 -179.071 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.622 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.4 OUTLIER -92.91 143.53 26.16 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.973 178.753 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.465 HG13 ' HB2' ' A' ' 47' ' ' LYS . 1.1 mm -118.55 120.47 64.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.263 -179.625 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -88.79 147.01 19.57 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.068 179.604 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -59.38 135.35 57.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.9 0.381 . . . . 0.0 111.077 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.487 ' CG2' ' N ' ' A' ' 67' ' ' ASP . 1.8 p -77.88 161.13 4.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.415 0.626 . . . . 0.0 111.563 -179.809 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.487 ' N ' ' CG2' ' A' ' 66' ' ' VAL . 91.2 m-20 -90.77 77.51 6.26 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.627 179.628 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -63.56 -15.98 59.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.377 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 34.0 m -55.26 -21.98 16.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.808 0.337 . . . . 0.0 111.072 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.6 mmtp -78.81 -68.23 0.67 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.864 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.1 mttp 59.86 92.98 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.988 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.422 ' O ' ' N ' ' A' ' 80' ' ' VAL . 20.0 mtm-85 -93.49 -176.95 4.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.414 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -125.82 153.78 43.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.982 0.42 . . . . 0.0 111.165 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -87.03 168.39 13.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.816 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -58.47 -21.05 50.16 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.4 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -90.99 7.53 39.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.614 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.82 -11.91 68.97 Favored Glycine 0 C--N 1.332 0.339 0 C-N-CA 120.511 -0.852 . . . . 0.0 112.755 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -66.72 175.48 2.37 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.74 0.305 . . . . 0.0 110.829 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -96.66 163.76 12.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.924 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.525 HG12 ' N ' ' A' ' 81' ' ' VAL . 22.1 t -135.72 157.78 39.16 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 CA-C-O 121.519 0.676 . . . . 0.0 111.869 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.525 ' N ' HG12 ' A' ' 80' ' ' VAL . 15.6 t -124.73 97.89 38.06 Favored Pre-proline 0 C--N 1.32 -0.715 0 CA-C-N 114.819 -1.082 . . . . 0.0 108.354 177.596 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -45.05 166.24 0.05 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.253 1.969 . . . . 0.0 112.61 -178.302 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.52 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 1.1 mtmm -84.53 137.16 39.08 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 120.934 0.397 . . . . 0.0 110.958 -179.752 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.52 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 10.1 Cg_exo -76.23 165.78 28.87 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 123.367 2.711 . . . . 0.0 112.613 -179.119 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -65.5 156.1 33.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.534 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 66.7 mtm180 -148.68 133.25 17.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.82 0.343 . . . . 0.0 111.154 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.413 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 46.6 m-70 -116.31 159.03 22.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.503 179.554 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.3 ttt -125.69 142.1 51.68 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.996 0.427 . . . . 0.0 111.37 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.558 ' CE2' HD11 ' A' ' 16' ' ' ILE . 95.9 m-85 -152.02 125.81 9.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.514 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.3 t -101.61 143.02 32.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.989 0.423 . . . . 0.0 111.18 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.66 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 54.2 m-85 -130.09 172.48 11.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.671 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 74.8 m-20 -132.36 23.38 4.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.184 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -154.08 116.43 4.34 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.832 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 9.0 mtt85 -57.73 -31.46 66.47 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.001 0.429 . . . . 0.0 110.751 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.03 -54.99 18.99 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.724 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 61.8 t -61.56 -37.55 78.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.186 179.319 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.507 ' HG3' ' CG ' ' A' ' 91' ' ' PHE . 1.4 ttp -69.3 -33.19 72.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.392 179.352 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.467 ' O ' ' HB3' ' A' ' 102' ' ' MET . 22.0 t70 -72.41 -25.13 61.37 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.146 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -80.98 -51.59 8.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.977 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 16.8 mm -53.83 -52.07 38.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.027 0.442 . . . . 0.0 110.782 179.695 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.619 ' HB2' HD11 ' A' ' 60' ' ' LEU . 0.6 OUTLIER -60.59 -27.86 68.04 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.93 179.726 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.467 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.8 OUTLIER -78.78 -43.96 24.3 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.902 -179.972 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.84 -44.31 70.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.087 -179.546 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.78 ' CD2' HD22 ' A' ' 42' ' ' LEU . 16.2 mt -58.33 -38.96 78.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.832 0.349 . . . . 0.0 110.971 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.77 ' HA ' HD12 ' A' ' 108' ' ' ILE . 2.0 mt-30 -63.09 -28.72 70.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.961 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -68.49 -37.21 79.9 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.819 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.029 HD13 HD13 ' A' ' 42' ' ' LEU . 3.4 mt -68.68 -44.55 82.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.335 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.77 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.1 mt -59.96 -61.02 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.618 0 CA-C-O 121.7 0.762 . . . . 0.0 109.319 179.024 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.5 t -50.6 -29.27 10.46 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.392 -1.276 . . . . 0.0 110.903 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 51.1 mtt180 -67.88 -33.81 75.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.079 0.466 . . . . 0.0 110.52 179.548 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -105.47 -0.97 25.45 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.911 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.839 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.5 t . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.814 0.34 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 76.2 m80 63.59 33.33 13.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.111 0.482 . . . . 0.0 111.14 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.584 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 64.2 p 178.25 171.83 0.71 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.841 179.139 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 155.78 119.15 0.63 Allowed Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.21 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.628 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -47.07 108.73 0.16 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.101 0.476 . . . . 0.0 111.404 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.814 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -123.7 153.18 41.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.81 -178.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.562 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.9 OUTLIER -99.72 124.36 53.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.976 0.417 . . . . 0.0 110.419 179.021 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.505 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 19.7 t80 -113.19 129.83 56.4 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.085 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.421 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 83.8 mt-10 57.08 34.46 24.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.894 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 29.2 mmtt 75.77 1.93 3.63 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.24 -179.16 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.522 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.9 t -100.78 154.39 4.58 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.634 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.562 ' HA ' HG13 ' A' ' 8' ' ' ILE . 79.9 p -96.67 148.7 22.6 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-O 121.557 0.694 . . . . 0.0 112.517 -178.786 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.484 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.15 -179.74 46.22 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-N 114.649 -1.16 . . . . 0.0 110.404 -179.823 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.628 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.41 141.55 21.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 117.611 0.706 . . . . 0.0 110.602 179.378 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.683 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.75 118.57 54.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 179.53 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.485 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -119.8 139.83 51.72 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.19 -178.667 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.513 ' CG1' HD12 ' A' ' 27' ' ' LEU . 94.1 mt -116.51 140.04 40.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.501 -178.897 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -125.56 111.37 14.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.7 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -94.21 7.88 43.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.244 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -80.43 -17.91 50.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.814 0.34 . . . . 0.0 110.346 179.362 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.49 ' CG2' ' N ' ' A' ' 23' ' ' SER . 0.6 OUTLIER -106.93 159.27 6.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.201 0.524 . . . . 0.0 111.227 -179.995 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.49 ' N ' ' CG2' ' A' ' 22' ' ' VAL . 7.1 m -131.27 121.54 18.61 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.811 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.431 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 5.7 Cg_exo -76.51 137.58 49.85 Favored 'Cis proline' 0 C--N 1.348 0.504 0 C-N-CA 123.529 -1.446 . . . . 0.0 111.873 -0.063 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.584 ' O ' HD22 ' A' ' 42' ' ' LEU . . . -44.74 140.8 2.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.679 179.614 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -127.36 158.48 37.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.324 0.583 . . . . 0.0 112.046 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.717 ' HB2' HD11 ' A' ' 42' ' ' LEU . 4.2 tt -121.39 129.9 53.3 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.127 179.064 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.0 m -121.05 125.95 48.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.255 0.55 . . . . 0.0 112.334 -178.753 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.485 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 63.6 t90 -100.6 128.39 46.67 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.647 178.937 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 55.2 ttt-85 -125.59 118.16 25.12 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.863 0.363 . . . . 0.0 111.02 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.484 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 33.3 m -45.63 166.58 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.92 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.02 -41.68 67.26 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.47 0.652 . . . . 0.0 109.754 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -100.37 -9.84 21.83 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.852 -1.067 . . . . 0.0 111.209 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 91.73 26.86 18.68 Favored Glycine 0 C--N 1.331 0.299 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.391 -179.769 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -71.61 -24.02 61.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.742 0.306 . . . . 0.0 111.673 -179.606 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.51 153.87 19.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.08 0.467 . . . . 0.0 111.489 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.8 t -139.04 132.81 39.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.699 179.593 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.505 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 15.7 t-80 -133.76 145.9 50.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.195 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.46 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 52.2 m -129.04 140.18 51.72 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.303 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 90.9 t -134.56 141.62 42.87 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.197 0 CA-C-O 121.152 0.501 . . . . 0.0 111.982 179.628 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.73 ' HB ' HG23 ' A' ' 44' ' ' THR . 0.0 OUTLIER -88.36 117.43 31.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.719 177.995 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.767 ' H ' HD22 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -68.3 -19.87 64.72 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 120.784 0.326 . . . . 0.0 110.502 179.464 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 86.0 p -65.03 -28.28 69.38 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.07 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.73 HG23 ' HB ' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -86.71 -26.5 24.21 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.715 179.725 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.884 HD12 ' HB3' ' A' ' 62' ' ' LEU . 45.9 mm -57.24 91.31 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.036 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -60.83 -30.58 70.19 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.035 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.622 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 35.4 mttt -152.36 157.44 41.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.927 0.394 . . . . 0.0 111.21 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.61 HD23 ' HG3' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -131.34 126.03 34.23 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.934 179.456 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -122.24 141.19 51.75 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.01 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.418 ' HB2' HD11 ' A' ' 60' ' ' LEU . . . -136.99 147.86 46.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.046 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.637 HG23 ' O ' ' A' ' 59' ' ' MET . 20.1 p -75.82 124.02 88.48 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.743 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.53 160.62 49.08 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.378 2.052 . . . . 0.0 112.408 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.675 ' HB2' ' HE ' ' A' ' 94' ' ' ARG . . . -58.68 -35.22 72.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.081 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.6 t -58.49 -25.84 62.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.005 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 32.7 t -98.57 115.01 27.68 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.822 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -58.26 -18.41 26.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.693 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.432 ' O ' HG21 ' A' ' 51' ' ' THR . 4.8 mtmm -71.45 97.37 1.63 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.985 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.501 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 12.0 mmm -82.1 108.27 15.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.765 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.637 ' O ' HG23 ' A' ' 51' ' ' THR . 1.3 tmm? -176.52 145.6 0.57 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.108 0.48 . . . . 0.0 111.742 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.493 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -115.69 159.99 20.65 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.938 179.354 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 7.3 tpt180 -145.86 127.72 15.4 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.884 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -105.56 144.17 32.69 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.316 179.126 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.622 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 2.4 mm -103.65 114.32 42.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.744 0.306 . . . . 0.0 111.416 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -79.32 129.19 8.99 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.106 179.339 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 20.6 mttt -52.03 148.14 6.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.939 0.4 . . . . 0.0 111.197 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.794 HG22 ' H ' ' A' ' 67' ' ' ASP . 2.1 p -108.76 -162.34 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.876 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.794 ' H ' HG22 ' A' ' 66' ' ' VAL . 5.7 t70 -156.7 71.49 0.69 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.97 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.525 ' CG ' HG13 ' A' ' 81' ' ' VAL . 42.0 mp0 -55.67 -21.56 18.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.466 -179.263 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.1 t -56.83 -19.68 18.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.084 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 32.3 mmtt -72.45 -47.67 47.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.978 0.418 . . . . 0.0 110.89 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.2 mmtt 62.85 94.7 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.923 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 15.0 mtt-85 -99.51 143.86 29.27 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.944 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.8 mmtp -87.48 145.66 26.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.005 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.495 ' HB3' HG11 ' A' ' 80' ' ' VAL . 43.6 p30 -97.44 177.6 5.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.107 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -60.99 -19.36 61.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.302 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -88.38 11.41 16.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.516 -179.711 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 68.67 17.62 71.24 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.708 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -117.09 146.24 43.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.94 0.4 . . . . 0.0 110.876 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -70.71 144.28 51.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.97 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.495 HG11 ' HB3' ' A' ' 74' ' ' ASP . 2.8 m -140.51 158.76 24.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.195 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.525 HG13 ' CG ' ' A' ' 68' ' ' GLU . 18.6 t -83.31 110.37 23.62 Favored Pre-proline 0 C--N 1.327 -0.378 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.429 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.44 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 71.7 Cg_exo -48.58 145.9 11.66 Favored 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 122.094 1.862 . . . . 0.0 112.668 -178.868 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.486 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 29.0 mttm -74.66 102.93 0.74 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.135 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.486 ' HD2' ' HA ' ' A' ' 83' ' ' LYS . 1.0 OUTLIER -40.17 149.38 0.14 Allowed 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 123.534 2.823 . . . . 0.0 112.642 179.275 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.36 155.15 36.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.771 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 55.6 mtt85 -153.49 119.83 5.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.68 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 84.4 m-70 -93.5 154.49 17.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.643 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.4 ttt -130.88 118.97 21.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.905 0.383 . . . . 0.0 111.484 -179.639 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.599 ' CE2' HD11 ' A' ' 16' ' ' ILE . 94.4 m-85 -127.73 125.47 40.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.215 179.478 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.98 131.44 44.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.995 0.426 . . . . 0.0 111.211 -179.538 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.814 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 12.1 m-85 -121.08 161.44 21.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.611 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.501 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 75.1 m-20 -124.63 29.34 6.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.009 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 74.8 m-80 -156.6 112.32 2.94 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.795 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.675 ' HE ' ' HB2' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -52.71 -28.17 20.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.05 0.453 . . . . 0.0 111.044 -179.971 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.435 HG22 ' N ' ' A' ' 96' ' ' VAL . 0.9 OUTLIER -77.43 -54.91 5.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.853 179.877 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.435 ' N ' HG22 ' A' ' 95' ' ' THR . 40.3 t -56.31 -44.76 80.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.87 -179.813 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.404 ' CG ' ' HA ' ' A' ' 94' ' ' ARG . 0.2 OUTLIER -65.84 -35.97 82.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.115 179.261 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -66.64 -33.01 74.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.562 179.48 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.437 ' O ' ' HB ' ' A' ' 103' ' ' THR . 76.6 m-20 -63.49 -35.43 80.41 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.874 179.309 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.54 HD12 ' CG2' ' A' ' 16' ' ' ILE . 21.5 mm -71.07 -51.99 30.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.577 179.362 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.593 ' HB2' HD11 ' A' ' 48' ' ' LEU . 11.3 pttp -64.53 -27.23 68.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.614 179.663 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 44.1 mtm -78.21 -38.36 43.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.521 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.458 HG21 HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -78.61 -38.11 40.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.611 179.728 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.643 HD21 HD12 ' A' ' 42' ' ' LEU . 12.0 mt -63.54 -40.36 96.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.592 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.827 ' HA ' HD12 ' A' ' 108' ' ' ILE . 12.1 mt-30 -62.99 -27.4 69.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.979 0.419 . . . . 0.0 111.04 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -70.41 -38.65 74.66 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.151 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.678 HD13 HD23 ' A' ' 42' ' ' LEU . 60.8 mt -68.81 -46.68 79.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.543 -179.654 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.827 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.6 mt -56.61 -60.17 2.22 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.621 0 CA-C-O 121.84 0.828 . . . . 0.0 109.507 179.187 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.7 m -48.78 -29.0 4.05 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.107 -1.406 . . . . 0.0 111.389 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 50.7 mtt-85 -70.82 -32.31 69.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.046 0.45 . . . . 0.0 110.809 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -95.6 -30.85 13.57 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.018 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.802 ' HD3' HG22 ' A' ' 108' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.577 179.709 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.3 t . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.778 0.323 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.408 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 59.3 m80 65.08 32.94 9.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.077 179.778 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.521 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 60.4 p -175.01 164.58 3.39 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.767 179.239 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.414 ' CA ' HG13 ' A' ' 96' ' ' VAL . . . 160.87 117.93 0.46 Allowed Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.383 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.631 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -47.06 110.46 0.3 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.085 0.469 . . . . 0.0 111.459 -179.695 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.761 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -125.61 150.78 47.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.632 -179.064 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.568 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -99.51 124.99 53.19 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-O 121.014 0.435 . . . . 0.0 110.443 179.332 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.515 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 7.1 t80 -112.93 130.73 56.01 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.163 179.75 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 55.88 34.28 23.25 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.944 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 78.7 mttt 76.11 1.5 3.45 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.274 -179.09 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.53 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.6 t -100.16 154.62 4.36 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.586 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.013 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.568 ' HA ' HG13 ' A' ' 8' ' ' ILE . 89.2 p -96.47 149.15 22.05 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.638 0.733 . . . . 0.0 112.785 -178.487 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.46 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.23 -179.77 46.27 Favored Glycine 0 N--CA 1.445 -0.705 0 CA-C-N 114.436 -1.256 . . . . 0.0 110.298 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.631 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.57 143.39 17.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 117.73 0.765 . . . . 0.0 110.438 179.352 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.887 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.75 118.3 54.22 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.682 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.625 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.486 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -121.64 133.82 54.98 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.345 -178.588 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.622 HG23 HD11 ' A' ' 42' ' ' LEU . 90.6 mt -106.33 140.1 25.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.184 -179.028 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -131.99 111.4 11.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.904 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -89.77 6.26 42.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.312 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -79.02 -18.05 54.25 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.906 0.384 . . . . 0.0 110.398 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -98.98 144.25 12.11 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.09 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.433 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.9 t -116.47 116.32 39.2 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.755 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.447 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 1.8 Cg_endo -80.01 143.8 67.41 Favored 'Cis proline' 0 C--N 1.349 0.562 0 C-N-CA 123.819 -1.326 . . . . 0.0 111.883 -0.05 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.56 140.68 4.19 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.884 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -134.25 167.21 21.12 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.251 0.548 . . . . 0.0 111.746 -179.328 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.887 HD21 HG12 ' A' ' 16' ' ' ILE . 6.0 tt -121.18 128.17 52.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.674 179.572 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.3 m -115.72 128.55 55.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.174 0.511 . . . . 0.0 112.339 -178.603 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.48 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 57.2 t90 -100.53 130.1 46.56 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.461 -0.791 . . . . 0.0 109.714 178.926 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 17.0 ttt180 -124.45 115.72 21.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.831 0.348 . . . . 0.0 110.947 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.46 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 3.8 p -45.45 166.38 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.109 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.65 -42.0 59.32 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 121.416 0.627 . . . . 0.0 109.792 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 48.7 p30 -81.94 -19.44 40.7 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.313 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.89 33.88 11.89 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.271 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -108.54 -21.37 12.75 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.731 0.271 . . . . 0.0 111.731 -179.698 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.486 ' HE2' HG21 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -128.27 134.52 48.96 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.885 0.374 . . . . 0.0 111.103 -179.793 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 12.2 p -139.3 137.79 40.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.063 179.713 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.515 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 20.3 t-80 -136.97 146.05 44.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.144 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 46.9 m -127.82 134.03 49.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.172 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.7 t -124.33 140.8 46.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.367 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.597 HG22 HG23 ' A' ' 44' ' ' THR . 2.0 p -85.3 117.61 30.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.12 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 1.021 HD13 HD13 ' A' ' 107' ' ' ILE . 83.5 mt -75.38 -29.67 59.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.982 -178.737 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.447 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 10.9 t -55.49 -22.16 19.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.867 -179.2 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.597 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -95.49 -22.14 17.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.719 0.295 . . . . 0.0 111.195 -179.896 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.796 HD12 ' HB3' ' A' ' 62' ' ' LEU . 36.7 mm -57.11 89.3 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.886 -179.795 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -74.32 -27.88 60.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.506 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.724 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 28.6 mtpt -141.13 146.04 36.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.132 0.492 . . . . 0.0 111.769 -179.289 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.694 HD23 ' HG2' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -132.33 124.95 29.8 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.607 179.301 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.664 ' O ' HD23 ' A' ' 60' ' ' LEU . 94.4 mt-30 -127.28 145.05 50.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.943 0.401 . . . . 0.0 111.552 -178.969 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -133.2 156.98 46.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.836 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 46.5 p -75.74 133.52 73.26 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.528 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.7 154.98 51.24 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.631 2.221 . . . . 0.0 112.557 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.33 -42.98 99.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.155 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.4 m -58.34 -27.53 64.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.09 0.472 . . . . 0.0 110.737 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 29.4 t -81.99 119.85 24.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.811 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -56.84 -18.44 13.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.438 179.199 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.6 mmtm -61.01 149.38 36.99 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.944 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.404 ' CE ' ' N ' ' A' ' 93' ' ' ASN . 15.6 mmm -133.78 79.98 1.85 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.672 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.423 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.6 OUTLIER -147.62 169.11 20.34 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.06 0.457 . . . . 0.0 112.037 -179.541 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.675 HD21 ' CD1' ' A' ' 48' ' ' LEU . 0.3 OUTLIER -144.69 131.13 19.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.872 179.47 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.469 ' HD2' HD13 ' A' ' 63' ' ' ILE . 4.0 tmm_? -113.48 132.34 55.7 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.043 0.449 . . . . 0.0 112.211 -178.893 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.796 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -110.48 140.64 44.55 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.229 179.246 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.724 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.2 mm -111.82 127.33 69.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.772 0.32 . . . . 0.0 111.328 179.72 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.56 129.66 9.98 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.217 179.594 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.6 mttt -44.35 145.63 0.79 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.833 0.349 . . . . 0.0 111.413 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.715 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.2 p -117.73 -162.05 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.815 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.715 ' H ' HG22 ' A' ' 66' ' ' VAL . 7.3 t0 -178.81 50.44 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.503 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -57.59 -22.5 45.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.334 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 23.7 t -62.1 -16.11 50.04 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.944 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.1 mttt -69.7 -39.95 76.6 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.094 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.8 mtmt 60.43 90.96 0.06 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.813 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 74.3 mmt-85 -94.4 143.88 26.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.022 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 45.4 mmtt -88.14 145.86 25.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.905 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -94.49 173.21 7.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.894 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -60.33 -20.03 57.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.23 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -86.64 4.79 38.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.426 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.3 15.22 81.73 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.606 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -111.72 144.69 40.6 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.812 0.339 . . . . 0.0 110.99 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -71.76 148.01 46.75 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.044 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.449 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 1.5 m -131.01 158.82 43.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.95 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 38.9 t -103.64 98.58 13.18 Favored Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.749 178.781 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.449 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 86.8 Cg_exo -46.2 162.61 0.12 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.411 2.074 . . . . 0.0 112.419 -179.106 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.507 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -117.8 143.79 33.19 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.745 179.928 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.507 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 15.2 Cg_exo -73.47 148.29 42.55 Favored 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 123.453 2.768 . . . . 0.0 112.695 -179.087 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -76.61 147.88 37.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.759 179.727 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.8 mtp180 -150.93 121.84 7.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.959 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -110.17 146.99 34.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.627 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -129.61 135.73 48.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.31 -179.723 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.683 ' CE1' HD11 ' A' ' 16' ' ' ILE . 97.7 m-85 -135.6 153.98 51.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.811 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.423 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.4 OUTLIER -126.55 123.89 38.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.912 0.387 . . . . 0.0 110.871 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.761 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 2.2 m-85 -112.87 172.74 6.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.808 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.4 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 23.6 p30 -124.69 26.35 7.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.218 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.404 ' N ' ' CE ' ' A' ' 58' ' ' MET . 80.4 m-20 -158.07 122.02 4.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.97 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -56.91 -35.18 68.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.191 0.519 . . . . 0.0 110.693 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.34 -50.26 60.71 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.014 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.414 HG13 ' CA ' ' A' ' 5' ' ' GLY . 52.4 t -59.48 -39.5 79.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.535 179.567 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.559 ' HG2' HD12 ' A' ' 60' ' ' LEU . 2.0 mtp -65.84 -36.58 83.86 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.525 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -68.96 -34.52 75.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.837 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.43 ' O ' ' HB ' ' A' ' 103' ' ' THR . 62.9 m-20 -61.5 -42.65 99.12 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.255 179.58 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.504 HD12 ' CG2' ' A' ' 16' ' ' ILE . 23.9 mm -66.49 -51.44 57.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.543 179.422 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.552 ' HB2' HD11 ' A' ' 48' ' ' LEU . 0.3 OUTLIER -65.52 -27.2 68.29 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.646 179.626 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.1 mmm -78.19 -37.5 45.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.445 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.43 ' HB ' ' O ' ' A' ' 99' ' ' ASN . 0.6 OUTLIER -80.69 -36.8 31.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.666 179.761 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.683 ' HA ' HD12 ' A' ' 107' ' ' ILE . 13.0 mt -63.64 -41.48 98.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.758 179.81 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.76 ' HA ' HD12 ' A' ' 108' ' ' ILE . 1.4 mt-30 -62.42 -28.46 69.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.022 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -69.53 -32.76 71.78 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.035 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.021 HD13 HD13 ' A' ' 42' ' ' LEU . 5.6 mt -75.11 -45.2 42.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.38 -179.675 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.76 HD12 ' HA ' ' A' ' 105' ' ' GLN . 1.9 mt -58.32 -61.13 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.556 0 CA-C-O 121.769 0.795 . . . . 0.0 109.428 179.282 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.4 m -50.72 -28.72 9.69 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.376 -1.284 . . . . 0.0 110.637 179.24 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.3 ttm180 -70.11 -48.31 58.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.263 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.417 ' CE2' ' HA ' ' A' ' 43' ' ' SER . 26.6 m-85 -74.44 -29.09 61.34 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.415 179.66 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 2.2 mttt . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.587 179.879 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.574 ' HG ' ' CE1' ' A' ' 3' ' ' HIS . 39.9 t . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.899 0.381 . . . . 0.0 110.912 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.574 ' CE1' ' HG ' ' A' ' 2' ' ' SER . 48.3 m80 -115.05 34.52 4.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.196 0.522 . . . . 0.0 110.93 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.496 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 19.2 p -171.29 141.91 1.65 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.59 179.154 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -172.54 118.19 0.7 Allowed Glycine 0 N--CA 1.446 -0.683 0 C-N-CA 120.531 -0.842 . . . . 0.0 112.429 179.854 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.642 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -45.68 103.25 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.122 0.487 . . . . 0.0 111.375 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.807 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -119.4 153.78 34.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.813 -178.914 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.649 HG23 ' O ' ' A' ' 12' ' ' VAL . 1.0 OUTLIER -99.98 126.59 53.43 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.255 0 CA-C-O 121.076 0.465 . . . . 0.0 110.372 178.968 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.505 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 22.2 t80 -114.68 128.12 56.14 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.03 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 82.8 mt-10 58.02 37.87 26.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.684 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 10' ' ' GLU . 2.3 mmtt 72.01 2.94 4.5 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.567 -179.153 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.649 ' O ' HG23 ' A' ' 8' ' ' ILE . 39.6 t -101.83 155.19 4.84 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.582 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 178.78 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.554 ' HA ' HG13 ' A' ' 8' ' ' ILE . 96.4 p -96.57 149.07 22.18 Favored 'General case' 0 C--N 1.313 -1.022 0 CA-C-O 121.594 0.712 . . . . 0.0 112.617 -178.557 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.464 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 175.64 -179.59 46.73 Favored Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 114.603 -1.18 . . . . 0.0 110.347 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.642 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.62 141.97 20.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 117.732 0.766 . . . . 0.0 110.53 179.413 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.851 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.68 118.38 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 179.551 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.411 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -119.64 135.0 54.99 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.353 -178.639 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.476 ' CG1' HD12 ' A' ' 27' ' ' LEU . 69.6 mt -107.16 140.12 26.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.597 -0.728 . . . . 0.0 111.171 -179.01 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 70.0 m-20 -132.08 113.25 13.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.925 -179.806 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -90.83 6.11 45.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.169 179.773 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 86.3 m-20 -79.48 -17.68 53.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.004 0.431 . . . . 0.0 110.478 179.443 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.68 143.77 13.15 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.985 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.436 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.8 t -116.94 116.16 38.21 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.867 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.442 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 2.0 Cg_endo -79.82 144.0 68.92 Favored 'Cis proline' 0 C--N 1.348 0.529 0 C-N-CA 123.782 -1.341 . . . . 0.0 111.954 0.049 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -45.68 140.68 3.27 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.014 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 68.5 mt-10 -133.62 167.11 21.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.247 0.546 . . . . 0.0 111.654 -179.22 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.851 HD21 HG12 ' A' ' 16' ' ' ILE . 4.3 tt -121.18 131.81 54.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.713 179.385 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.4 m -118.32 126.98 53.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.072 0.463 . . . . 0.0 112.093 -178.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.495 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 60.0 t90 -100.52 130.2 46.56 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.974 179.13 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 8.3 ttt85 -125.28 115.8 20.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.799 0.333 . . . . 0.0 110.912 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.464 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 29.5 t -45.49 166.54 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.142 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.07 -42.08 60.74 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.38 0.61 . . . . 0.0 109.663 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 89.7 m-20 -80.07 -22.72 41.94 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.126 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.57 32.96 10.67 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.469 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -108.31 -19.26 13.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.612 0.244 . . . . 0.0 111.471 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.468 ' HE2' HG21 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -127.96 134.95 49.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.791 0.329 . . . . 0.0 111.085 -179.867 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 11.8 p -138.98 139.09 41.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.11 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.505 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 25.9 t-80 -135.82 146.14 47.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.124 0.488 . . . . 0.0 111.253 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 42.0 m -127.52 135.13 49.93 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.846 179.82 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 99.4 t -130.77 140.82 47.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.012 0.434 . . . . 0.0 111.601 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.654 HG22 HG23 ' A' ' 44' ' ' THR . 1.4 p -84.98 117.8 30.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 178.121 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 1.064 HD22 HD21 ' A' ' 104' ' ' LEU . 45.3 mt -75.44 -30.14 59.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.969 -178.622 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.442 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 11.7 t -55.27 -21.7 15.47 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.096 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.654 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -89.37 -22.97 22.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.795 0.331 . . . . 0.0 111.213 -179.7 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.51 HG12 ' HA ' ' A' ' 42' ' ' LEU . 48.3 mm -48.41 106.49 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.953 0.406 . . . . 0.0 111.206 -179.618 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -99.46 -20.09 16.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.404 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.442 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 51.2 mttp -154.53 133.01 11.99 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.961 0.41 . . . . 0.0 111.419 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.723 HD11 ' HB3' ' A' ' 104' ' ' LEU . 87.4 mt -107.7 124.36 49.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.664 179.67 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.492 ' O ' HD23 ' A' ' 60' ' ' LEU . 1.7 tt0 -113.78 134.95 54.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.633 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.608 ' HB1' ' HE1' ' A' ' 97' ' ' MET . . . -142.34 144.99 33.45 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.882 0.372 . . . . 0.0 111.19 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.471 HG22 ' HE2' ' A' ' 57' ' ' LYS . 72.9 p -75.87 129.99 79.72 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.765 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.5 154.31 74.78 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.538 2.159 . . . . 0.0 112.371 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.95 -34.53 74.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.125 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.1 m -59.08 -27.63 65.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.008 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 71.4 m -82.64 120.29 25.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.965 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -58.5 -17.74 23.56 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.525 179.288 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.471 ' HE2' HG22 ' A' ' 51' ' ' THR . 0.0 OUTLIER -84.61 148.2 26.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.184 -179.852 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.409 ' HE2' ' HB3' ' A' ' 58' ' ' MET . 17.5 mmm -119.45 128.35 53.92 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.683 -179.272 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.481 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.6 OUTLIER -179.88 165.25 1.24 Allowed 'General case' 0 N--CA 1.462 0.136 0 CA-C-O 121.251 0.548 . . . . 0.0 112.331 179.771 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.887 HD11 ' HB3' ' A' ' 101' ' ' LYS . 1.2 tt -148.48 137.3 21.6 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.305 -0.862 . . . . 0.0 109.776 179.535 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.35 126.72 47.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.985 0.421 . . . . 0.0 112.008 -179.186 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.463 HD11 HD22 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -99.74 139.65 35.08 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.015 179.038 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.463 HD13 ' HG2' ' A' ' 86' ' ' ARG . 1.0 OUTLIER -118.67 127.89 75.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.164 -179.761 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -95.78 156.79 21.55 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.237 179.671 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.4 mttp -58.3 157.9 7.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.81 0.338 . . . . 0.0 111.0 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.716 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.2 p -121.86 -162.1 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.966 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.716 ' H ' HG22 ' A' ' 66' ' ' VAL . 54.1 t0 -172.04 61.88 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.278 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.426 ' HB3' HG23 ' A' ' 81' ' ' VAL . 95.1 mt-10 -58.23 -20.79 44.59 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.245 -179.627 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 37.9 m -57.7 -19.08 24.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.087 179.788 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -61.68 -47.08 86.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.988 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp 62.64 95.31 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.819 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 42.9 mmt180 -103.18 165.44 11.02 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.816 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -125.55 145.3 50.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.979 0.419 . . . . 0.0 111.103 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -85.22 173.01 10.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.872 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.75 -17.76 61.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.291 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -87.65 6.99 31.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.45 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 81.73 -1.35 86.43 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.596 -0.812 . . . . 0.0 112.751 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 25.6 m120 -84.0 159.49 21.21 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.732 0.301 . . . . 0.0 110.765 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -95.95 147.6 23.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.864 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.427 ' CG2' ' N ' ' A' ' 81' ' ' VAL . 0.2 OUTLIER -140.56 152.66 21.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.597 0.713 . . . . 0.0 111.255 -179.997 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.547 HG13 ' O ' ' A' ' 81' ' ' VAL . 5.7 p -103.24 100.1 16.74 Favored Pre-proline 0 C--N 1.32 -0.708 0 CA-C-N 114.487 -1.233 . . . . 0.0 110.634 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -46.8 145.27 6.99 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.409 2.073 . . . . 0.0 112.509 -179.5 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -91.42 151.01 42.28 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.047 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.468 ' HA ' HG23 ' A' ' 66' ' ' VAL . 17.0 Cg_exo -72.49 161.09 45.14 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 123.466 2.777 . . . . 0.0 112.716 -178.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -65.36 138.1 57.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.749 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.463 ' HG2' HD13 ' A' ' 63' ' ' ILE . 6.2 mtp-105 -139.81 119.89 13.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.906 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.412 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 86.2 m-70 -110.22 157.44 19.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.725 179.733 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 3.1 ttt -127.34 140.55 52.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.95 0.405 . . . . 0.0 111.337 -179.663 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.67 ' CE1' HD11 ' A' ' 16' ' ' ILE . 97.9 m-85 -150.69 127.77 11.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.572 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.481 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 14.4 t -107.21 132.48 53.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.906 0.384 . . . . 0.0 111.326 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.807 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 3.4 m-85 -122.29 172.32 8.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.646 179.615 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -128.67 26.21 5.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.966 179.597 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -152.94 119.64 5.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.524 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -55.13 -34.0 63.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.017 0.437 . . . . 0.0 110.937 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.06 -55.29 6.71 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.124 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 48.1 t -60.02 -41.15 85.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.969 0.414 . . . . 0.0 110.198 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.608 ' HE1' ' HB1' ' A' ' 50' ' ' ALA . 0.1 OUTLIER -67.76 -37.15 81.72 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.529 179.632 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.424 ' HA ' ' HG2' ' A' ' 101' ' ' LYS . 84.0 m-20 -76.09 -31.3 58.66 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.967 0.413 . . . . 0.0 111.039 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.421 ' O ' ' HB ' ' A' ' 103' ' ' THR . 94.5 m-20 -59.53 -41.35 89.81 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.379 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.633 HG22 HD12 ' A' ' 104' ' ' LEU . 24.5 mm -65.66 -51.89 57.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.504 179.424 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.887 ' HB3' HD11 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -65.32 -27.13 68.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.476 179.516 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.404 ' N ' ' HG3' ' A' ' 101' ' ' LYS . 43.4 mtm -78.43 -40.28 36.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.708 179.855 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.439 HG22 HD13 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -76.59 -38.83 54.21 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.63 179.846 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 1.064 HD21 HD22 ' A' ' 42' ' ' LEU . 6.5 mt -61.19 -38.98 88.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.572 179.735 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.668 ' HA ' HD12 ' A' ' 108' ' ' ILE . 1.0 OUTLIER -59.0 -32.33 69.61 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.043 0.449 . . . . 0.0 110.427 179.454 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -66.44 -31.24 71.87 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.056 179.087 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.521 HG21 ' CB ' ' A' ' 42' ' ' LEU . 10.0 mm -69.22 -56.7 10.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.579 179.461 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.668 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.2 mt -50.66 -61.08 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.542 0 CA-C-O 121.783 0.801 . . . . 0.0 109.662 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.2 m -51.66 -28.9 15.94 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 114.235 -1.348 . . . . 0.0 110.674 179.313 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.404 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 4.1 mtt-85 -67.33 -40.44 85.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.41 179.483 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.407 ' CZ ' ' HB2' ' A' ' 43' ' ' SER . 86.5 m-85 -84.35 -28.28 27.14 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.382 179.489 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.499 ' CE ' HG22 ' A' ' 108' ' ' ILE . 20.2 mttt . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.497 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.401 ' CB ' ' ND2' ' A' ' 99' ' ' ASN . 11.8 Cg_endo . . . . . 0 N--CA 1.477 0.519 0 CA-C-O 120.909 0.295 . . . . 0.0 111.806 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.3 m -143.26 128.04 18.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.873 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 35.4 m80 63.29 33.58 13.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.287 0.565 . . . . 0.0 111.08 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.529 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 54.9 p 177.59 129.28 0.05 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.637 179.189 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -164.04 114.47 0.6 Allowed Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.598 -0.811 . . . . 0.0 112.335 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.642 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -43.7 100.57 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.165 0.507 . . . . 0.0 111.436 -179.76 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.821 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -116.54 154.71 29.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.909 -178.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.685 HG23 ' O ' ' A' ' 12' ' ' VAL . 1.0 OUTLIER -101.78 126.63 55.69 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 CA-C-O 121.105 0.479 . . . . 0.0 110.443 178.967 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.499 ' CD1' ' CE2' ' A' ' 89' ' ' PHE . 15.4 t80 -114.0 130.67 56.53 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.208 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.427 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 37.4 mt-10 55.73 35.08 24.63 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.024 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 28.2 mttm 76.24 1.28 3.39 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.394 -179.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.685 ' O ' HG23 ' A' ' 8' ' ' ILE . 42.1 t -99.6 156.68 3.94 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.644 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 178.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.554 ' HA ' HG13 ' A' ' 8' ' ' ILE . 91.1 p -98.86 149.68 22.66 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-O 121.435 0.636 . . . . 0.0 112.408 -178.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.476 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 174.53 -179.53 45.79 Favored Glycine 0 N--CA 1.447 -0.624 0 N-CA-C 110.281 -1.128 . . . . 0.0 110.281 -179.746 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.642 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.45 142.49 19.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 117.719 0.76 . . . . 0.0 110.493 179.368 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.836 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.63 118.29 54.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 179.784 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -120.19 136.83 54.5 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.17 0.51 . . . . 0.0 111.533 -178.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.695 HG23 HD11 ' A' ' 42' ' ' LEU . 88.5 mt -109.95 140.03 30.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.095 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.8 t-20 -131.29 111.56 11.99 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.915 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -91.54 6.64 44.85 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.275 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 50.8 t0 -79.56 -17.99 52.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.921 0.391 . . . . 0.0 110.333 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -102.78 144.17 14.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.903 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.438 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 70.3 m -116.15 118.89 37.5 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.969 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.438 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 1.8 Cg_endo -80.84 137.88 40.98 Favored 'Cis proline' 0 C--N 1.348 0.519 0 C-N-CA 123.768 -1.347 . . . . 0.0 111.891 -0.178 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -42.95 140.61 1.33 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.068 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -132.46 167.06 20.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.213 0.53 . . . . 0.0 111.81 -179.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.836 HD21 HG12 ' A' ' 16' ' ' ILE . 5.2 tt -121.11 131.18 54.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.788 179.374 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 45.2 m -118.75 126.27 51.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.062 0.458 . . . . 0.0 112.047 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.493 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 62.2 t90 -100.43 128.14 46.57 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.814 178.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.452 ' HG2' HG22 ' A' ' 37' ' ' VAL . 0.0 OUTLIER -125.02 118.8 27.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.841 0.353 . . . . 0.0 111.062 -179.843 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.441 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 30.7 t -45.44 167.18 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.314 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.3 -42.78 53.95 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.491 0.662 . . . . 0.0 109.748 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -85.22 -17.83 35.88 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.91 -1.041 . . . . 0.0 111.109 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.74 33.9 12.25 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.359 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -98.83 -22.08 16.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.625 0.25 . . . . 0.0 111.568 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.12 144.11 40.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.989 0.423 . . . . 0.0 111.379 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.452 HG22 ' HG2' ' A' ' 30' ' ' ARG . 42.4 t -139.23 144.06 29.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.758 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.493 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 49.3 t60 -137.27 145.95 44.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.03 0.443 . . . . 0.0 111.415 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.2 m -128.77 137.87 51.78 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.797 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 88.5 t -135.98 140.86 43.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.997 0.427 . . . . 0.0 111.663 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.653 HG22 HG23 ' A' ' 44' ' ' THR . 1.7 p -83.25 117.36 28.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 177.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.941 HD13 HD13 ' A' ' 107' ' ' ILE . 85.8 mt -75.63 -34.27 60.55 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.162 -0.472 . . . . 0.0 112.187 -178.612 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.422 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 22.4 t -51.07 -24.62 4.07 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.031 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.653 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -85.81 -23.7 27.09 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.816 0.341 . . . . 0.0 111.142 -179.693 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.537 HG12 ' HA ' ' A' ' 42' ' ' LEU . 41.9 mm -47.27 101.5 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.314 -179.653 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.402 ' N ' ' O ' ' A' ' 63' ' ' ILE . 11.2 t70 -95.25 -20.7 18.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.444 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.523 ' HB2' HG13 ' A' ' 63' ' ' ILE . 46.1 mtmt -153.33 138.58 17.47 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.939 0.399 . . . . 0.0 111.286 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.612 HD21 ' HB3' ' A' ' 104' ' ' LEU . 34.1 mt -109.59 124.35 50.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.899 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.401 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 25.9 mt-30 -109.91 130.48 55.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.398 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.662 ' HB3' ' HE2' ' A' ' 101' ' ' LYS . . . -145.81 138.95 26.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.097 -179.714 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 70.0 p -75.76 133.66 73.03 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.549 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.39 149.94 78.2 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.593 2.196 . . . . 0.0 112.443 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.02 -41.68 97.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.142 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 87.3 p -59.29 -26.17 64.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.867 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.9 t -87.73 118.91 27.55 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.874 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -57.7 -18.45 20.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.389 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 30.3 mmtt -65.51 110.07 2.57 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.995 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.464 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 19.0 mmm -94.49 123.9 38.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.44 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.437 ' CE ' ' CE3' ' B' ' 53' ' ' TRP . 11.5 ttm -177.18 160.42 1.73 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.224 0.535 . . . . 0.0 111.994 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.3 tp -148.46 123.91 10.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.86 179.388 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.401 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 33.0 mtt180 -116.47 136.68 52.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.141 0.496 . . . . 0.0 112.039 -178.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.424 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -111.55 131.0 55.55 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.884 179.02 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.523 HG13 ' HB2' ' A' ' 47' ' ' LYS . 1.0 OUTLIER -109.07 122.14 63.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.128 -179.365 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.58 145.96 17.89 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.354 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.9 mttt -58.62 158.82 7.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.854 0.359 . . . . 0.0 110.959 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.69 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.1 p -121.55 -162.13 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.894 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.69 ' H ' HG22 ' A' ' 66' ' ' VAL . 5.3 m-20 -175.99 55.41 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.33 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -58.3 -21.55 49.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.279 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 35.6 m -59.58 -17.96 37.06 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.061 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -69.05 -38.75 79.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.043 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.3 mptt 59.62 92.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.819 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.423 ' O ' HG22 ' A' ' 80' ' ' VAL . 43.0 mmt180 -95.2 140.87 29.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.991 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 26.1 mmtp -87.6 145.64 26.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.986 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -93.43 172.51 8.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.887 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -60.07 -19.98 55.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.328 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 51.2 mp0 -86.41 4.63 38.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.422 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.62 14.36 82.52 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.699 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -110.45 144.73 38.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.912 0.387 . . . . 0.0 110.948 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -70.96 148.97 47.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.105 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.462 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.1 m -132.21 158.83 43.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.932 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.5 t -102.66 98.62 11.43 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.671 178.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.462 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 85.0 Cg_exo -45.61 161.66 0.12 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.428 2.085 . . . . 0.0 112.546 -179.095 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -115.0 150.47 44.25 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.054 0.454 . . . . 0.0 110.978 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -72.56 147.41 45.87 Favored 'Trans proline' 0 N--CA 1.465 -0.164 0 C-N-CA 123.466 2.777 . . . . 0.0 112.728 -179.002 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -72.5 142.36 48.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.796 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.403 ' HG2' HG23 ' A' ' 63' ' ' ILE . 87.0 mtt180 -150.68 119.95 6.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.853 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -105.7 159.06 16.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.671 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.0 ttt -131.74 121.43 24.2 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.929 0.395 . . . . 0.0 111.33 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.646 ' CE2' HD11 ' A' ' 16' ' ' ILE . 91.8 m-85 -128.67 154.0 46.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.505 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 33.1 t -126.68 134.13 50.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.951 0.405 . . . . 0.0 111.141 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.821 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 83.3 m-85 -120.37 162.07 20.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.48 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.464 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 8.9 m120 -109.43 -21.28 12.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.214 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.566 ' HB2' HG23 ' A' ' 96' ' ' VAL . 87.0 m-20 -116.51 112.6 21.61 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.658 179.753 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -48.06 -29.38 3.5 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.02 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.5 -48.92 63.16 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.119 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.566 HG23 ' HB2' ' A' ' 93' ' ' ASN . 52.6 t -58.79 -52.73 56.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.416 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.482 ' HB3' ' CG ' ' A' ' 91' ' ' PHE . 4.0 ptm -62.91 -32.11 73.32 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.464 ' O ' ' HB3' ' A' ' 102' ' ' MET . 12.0 m-20 -63.63 -34.2 77.32 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.182 179.284 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.401 ' ND2' ' CB ' ' A' ' 1' ' ' PRO . 83.5 m-20 -72.05 -44.18 63.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.483 179.473 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.501 HD12 ' CG2' ' A' ' 16' ' ' ILE . 23.4 mm -60.14 -50.52 79.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.568 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.662 ' HE2' ' HB3' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -61.7 -30.92 71.06 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.939 179.855 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.464 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.1 OUTLIER -79.09 -43.72 23.55 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.506 179.83 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.497 HG21 HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -67.47 -42.69 82.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.849 -179.801 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.818 ' CD2' HD22 ' A' ' 42' ' ' LEU . 35.9 mt -61.7 -39.49 91.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.556 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.519 ' HA ' HD12 ' A' ' 108' ' ' ILE . 36.5 mt-30 -60.86 -32.26 71.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.686 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -68.56 -29.48 68.05 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.812 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.941 HD13 HD13 ' A' ' 42' ' ' LEU . 23.4 mt -77.25 -50.44 20.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.319 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.519 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.3 mt -56.58 -61.1 1.32 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.622 0 CA-C-O 121.749 0.785 . . . . 0.0 109.268 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.6 t -50.56 -28.83 9.37 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.394 -1.275 . . . . 0.0 110.574 179.141 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 2.2 mtt180 -65.66 -39.83 91.8 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.663 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -85.9 -30.05 23.16 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.592 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.453 ' HE3' HG22 ' A' ' 108' ' ' ILE . 1.6 mttt -63.85 -45.24 90.38 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.465 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -59.86 -37.02 78.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.93 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.06 -33.95 76.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.145 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 22.8 t70 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.865 -179.961 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 45' ' ' LEU . . . . . 0.605 HD13 ' O ' ' B' ' 45' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.8 0.334 . . . . 0.0 111.164 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.7 m -121.39 161.43 41.27 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.927 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_exo -51.95 -41.42 63.77 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.59 2.193 . . . . 0.0 112.372 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -56.91 -28.12 61.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.984 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -63.64 -47.73 80.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.771 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 40.0 mm -68.62 -27.48 36.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.19 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -65.88 -32.78 74.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.778 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -30.66 69.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.927 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 53' ' ' TRP . . . . . 0.437 ' CE3' ' CE ' ' A' ' 59' ' ' MET . 11.7 m95 -55.71 -32.51 63.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.834 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 54' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -82.08 -28.15 32.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.974 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -77.58 -44.96 26.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.777 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 44.5 -166.21 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.462 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -139.81 138.79 20.35 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.792 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo . . . . . 0 C--O 1.25 1.076 0 C-N-CA 122.427 2.084 . . . . 0.0 112.259 -179.965 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo . . . . . 0 N--CA 1.475 0.434 0 CA-C-O 120.777 0.24 . . . . 0.0 111.807 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.0 m -177.68 -39.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.972 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.416 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 58.8 m80 -134.93 35.46 3.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.169 0.509 . . . . 0.0 110.927 -179.684 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.537 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 58.7 p -178.61 114.96 0.07 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.919 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.424 ' O ' ' C ' ' A' ' 6' ' ' ALA . . . -146.2 113.24 0.67 Allowed Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.946 -0.645 . . . . 0.0 111.978 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.549 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -32.71 121.13 0.34 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.741 0.305 . . . . 0.0 111.327 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.716 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -137.35 149.96 47.38 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -178.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.597 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.2 mp -98.14 124.31 51.14 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.306 0 CA-C-O 121.119 0.485 . . . . 0.0 110.408 179.189 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.502 ' CD1' ' CE2' ' A' ' 89' ' ' PHE . 14.7 t80 -115.85 130.6 56.9 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.069 179.617 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 58.27 33.71 23.4 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.824 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.1 mttm 75.64 1.34 3.57 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.084 -178.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.485 ' O ' HG23 ' A' ' 8' ' ' ILE . 31.3 t -100.8 149.76 6.04 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.728 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.597 ' HA ' HG13 ' A' ' 8' ' ' ILE . 66.7 p -88.25 145.94 25.6 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.548 -179.415 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.449 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -175.54 -179.24 45.95 Favored Glycine 0 N--CA 1.442 -0.93 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.668 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.549 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 8.0 mm -106.69 136.32 41.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 CA-C-O 120.792 0.329 . . . . 0.0 110.138 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.652 HG12 HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -106.63 117.81 53.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 178.939 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.483 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -124.18 125.5 44.55 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.239 0.542 . . . . 0.0 111.551 -178.076 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.439 ' CD1' HG22 ' A' ' 103' ' ' THR . 33.7 mt -94.55 139.97 17.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.809 -179.567 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -131.41 113.76 14.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.031 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -91.01 5.47 48.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.239 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -78.59 -17.96 55.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.937 0.399 . . . . 0.0 110.428 179.254 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.33 143.96 12.7 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.824 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.422 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 1.4 t -119.61 116.15 33.44 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.966 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.483 ' HB2' ' CB ' ' A' ' 43' ' ' SER . 72.1 Cg_endo -77.39 148.41 87.08 Favored 'Cis proline' 0 C--N 1.348 0.544 0 C-N-CA 123.258 -1.559 . . . . 0.0 112.29 -0.098 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.56 139.37 7.02 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.793 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -130.66 166.98 19.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.192 0.52 . . . . 0.0 111.577 -179.22 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.652 HD21 HG12 ' A' ' 16' ' ' ILE . 4.8 tt -121.16 128.61 52.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.824 179.473 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.7 m -116.08 127.2 54.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.065 0.46 . . . . 0.0 111.821 -179.087 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.496 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 55.3 t90 -100.45 125.15 46.71 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.108 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.834 ' HD2' HG22 ' A' ' 37' ' ' VAL . 14.6 tpt180 -120.92 116.65 25.53 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.589 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 26.3 t -44.54 156.8 0.07 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.675 0.274 . . . . 0.0 110.879 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.449 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -65.94 -39.42 90.48 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 121.586 0.708 . . . . 0.0 109.305 179.866 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -88.16 -20.01 26.18 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.603 -1.18 . . . . 0.0 111.091 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.58 33.48 11.41 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.483 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -97.59 -22.31 16.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.704 0.288 . . . . 0.0 111.525 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.94 145.01 43.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.208 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.834 HG22 ' HD2' ' A' ' 30' ' ' ARG . 38.8 t -139.14 140.0 38.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.185 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.502 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 12.5 t-80 -139.61 145.84 39.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.401 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 52.4 m -129.02 138.44 51.92 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.97 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 85.4 t -132.61 140.91 46.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 121.151 0.5 . . . . 0.0 111.846 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.566 HG22 HG23 ' A' ' 44' ' ' THR . 2.1 p -87.42 118.12 32.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.166 178.027 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.994 HD13 HD13 ' A' ' 107' ' ' ILE . 84.3 mt -74.92 -31.77 61.63 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -178.305 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.483 ' CB ' ' HB2' ' A' ' 24' ' ' PRO . 3.2 t -53.74 -24.66 15.62 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.566 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -92.0 -22.41 19.99 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.806 0.336 . . . . 0.0 111.13 -179.791 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.567 HD12 ' HB3' ' A' ' 62' ' ' LEU . 46.4 mm -56.2 91.91 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.11 0.481 . . . . 0.0 110.844 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -63.36 -29.55 70.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.394 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.635 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 0.3 OUTLIER -153.99 157.41 39.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.09 0.471 . . . . 0.0 111.587 -179.751 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.632 HD23 ' HG3' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -128.34 127.59 42.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.544 179.138 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.766 ' O ' HD23 ' A' ' 60' ' ' LEU . 96.7 mt-30 -115.99 141.27 48.34 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.006 0.432 . . . . 0.0 111.548 -179.102 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.497 ' HB2' HD21 ' A' ' 60' ' ' LEU . . . -148.12 135.36 20.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.699 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 68.7 p -75.79 131.49 76.48 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.823 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -69.25 160.66 48.97 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.527 2.152 . . . . 0.0 112.404 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.9 -40.56 73.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.159 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 86.0 p -62.75 -26.79 68.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.816 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 41.2 t -75.74 121.7 22.92 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.92 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -56.25 -18.69 11.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.273 179.047 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.04 154.48 35.65 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.717 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.461 ' HE2' ' O ' ' A' ' 91' ' ' PHE . 63.6 mtp -143.07 79.75 1.66 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.916 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.4 mpp? -155.24 169.1 24.97 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.049 0.452 . . . . 0.0 111.446 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.766 HD23 ' O ' ' A' ' 49' ' ' GLN . 0.2 OUTLIER -132.36 124.24 28.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.989 179.33 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.415 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 2.6 mmt180 -107.83 121.95 45.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.954 0.407 . . . . 0.0 111.846 -179.051 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.567 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -102.7 134.8 45.49 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.141 178.968 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.635 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.3 mm -99.95 150.13 5.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.532 -0.303 . . . . 0.0 111.069 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -115.62 134.28 11.42 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.206 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 25.7 mttt -53.78 139.52 32.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.852 0.358 . . . . 0.0 111.066 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.74 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.4 p -113.3 -161.92 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.956 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.74 ' H ' HG22 ' A' ' 66' ' ' VAL . 0.2 OUTLIER -176.97 67.79 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.141 179.923 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.633 ' OE2' HG11 ' A' ' 66' ' ' VAL . 50.8 mp0 -58.31 -20.87 46.46 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.426 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 27.0 t -58.97 -17.98 29.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.176 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 52.7 mmtt -62.41 -44.02 97.43 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.777 0.323 . . . . 0.0 111.142 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 60.38 92.99 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.774 -179.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 14.1 mtt-85 -106.55 150.6 25.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.989 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.9 mmtt -96.64 149.05 22.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.91 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -96.58 171.66 8.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.866 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -59.68 -20.19 54.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.283 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -86.76 5.96 33.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.389 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.12 15.92 81.06 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.573 -0.823 . . . . 0.0 112.638 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -111.91 145.26 39.85 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.9 0.381 . . . . 0.0 110.943 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -74.04 145.74 44.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.942 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.478 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.2 m -130.53 158.92 42.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.062 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 19.0 t -101.62 98.66 9.9 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.698 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.478 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 80.8 Cg_exo -44.59 145.41 2.69 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.369 2.046 . . . . 0.0 112.651 -179.083 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.449 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 13.1 mtmt -100.67 148.54 35.14 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.953 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 16.8 Cg_exo -72.41 150.52 52.34 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 123.425 2.75 . . . . 0.0 112.654 -178.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -70.89 153.93 42.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.839 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.6 mpp_? -156.5 119.99 4.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.844 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 62.1 m-70 -100.61 155.76 17.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.575 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.527 ' HE1' HD12 ' B' ' 50' ' ' ILE . 23.9 ttt -129.13 125.23 36.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.903 0.382 . . . . 0.0 111.249 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.502 ' CE2' ' CD1' ' A' ' 9' ' ' PHE . 91.9 m-85 -130.86 146.38 52.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.484 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 5.8 t -119.39 133.64 55.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.867 0.365 . . . . 0.0 110.983 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.716 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 2.5 m-85 -125.96 136.35 52.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.82 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 34.2 m-20 -97.1 22.2 8.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.791 0.329 . . . . 0.0 111.076 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -144.99 107.28 4.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.573 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -52.83 -28.82 24.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.071 0.463 . . . . 0.0 111.055 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -77.16 -54.9 5.93 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.303 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 53.4 t -53.87 -46.97 64.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.856 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.66 -35.6 80.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.29 179.514 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -65.86 -32.79 74.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.559 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -66.71 -41.05 88.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.117 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.553 HD12 ' CG2' ' A' ' 16' ' ' ILE . 22.6 mm -66.29 -48.75 80.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.518 179.44 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.601 ' HB2' HD11 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -66.56 -27.63 67.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.57 179.664 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 40.6 mtm -78.48 -39.08 39.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.616 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.439 HG22 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -80.62 -32.03 36.44 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.658 179.841 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.753 ' HA ' HD12 ' A' ' 107' ' ' ILE . 13.6 mt -65.99 -39.33 90.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.621 179.741 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.816 ' HA ' HD12 ' A' ' 108' ' ' ILE . 10.6 mt-30 -62.71 -26.83 68.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.883 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -70.33 -43.73 69.69 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.951 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.994 HD13 HD13 ' A' ' 42' ' ' LEU . 4.1 mt -61.86 -47.02 95.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.327 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.911 HG22 ' CD ' ' A' ' 112' ' ' LYS . 2.6 mt -57.43 -60.03 2.58 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.572 0 CA-C-O 121.838 0.828 . . . . 0.0 109.347 179.181 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.1 m -48.78 -28.92 3.99 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.088 -1.414 . . . . 0.0 111.266 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.47 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 35.3 mtt-85 -69.26 -32.54 71.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.044 0.45 . . . . 0.0 110.809 179.686 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -90.01 -28.8 18.85 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.926 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.911 ' CD ' HG22 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -66.84 -38.31 86.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.881 0.372 . . . . 0.0 110.543 179.568 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -62.13 -37.59 85.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.919 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.89 -33.43 75.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.079 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 89.7 m-20 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.173 -0.918 . . . . 0.0 110.857 179.989 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 74.8 mt . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.813 0.34 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -126.24 157.66 69.26 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.862 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -51.28 -40.43 61.26 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.594 2.196 . . . . 0.0 112.38 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 93.4 m-20 -58.67 -27.68 65.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.96 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -64.55 -42.88 95.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.875 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.527 HD12 ' HE1' ' A' ' 88' ' ' MET . 38.4 mm -66.88 -23.88 31.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.319 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -63.87 -34.68 78.48 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.876 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.46 -30.43 68.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.025 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 53' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -55.88 -31.93 63.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.812 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 54' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -89.0 -25.31 22.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.972 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.46 -33.25 60.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.817 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -74.97 136.73 41.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.929 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -147.66 161.55 35.02 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.937 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo . . . . . 0 C--O 1.248 0.976 0 C-N-CA 122.553 2.169 . . . . 0.0 112.272 -179.949 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo . . . . . 0 N--CA 1.475 0.396 0 CA-C-O 120.772 0.238 . . . . 0.0 111.785 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.2 t 61.04 114.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.049 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 61.4 m80 64.42 32.5 11.89 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.172 0.511 . . . . 0.0 110.989 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.557 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 77.4 p 177.6 161.73 0.52 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.594 179.237 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.522 ' CA ' HG13 ' A' ' 96' ' ' VAL . . . 162.78 116.19 0.37 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.296 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.65 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -46.64 103.6 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.192 0.52 . . . . 0.0 111.431 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.833 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -118.87 152.23 36.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.769 -178.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.641 HG23 ' O ' ' A' ' 12' ' ' VAL . 1.0 OUTLIER -99.55 125.25 53.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.072 0.463 . . . . 0.0 110.419 179.009 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.507 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 10.0 t80 -113.34 130.12 56.36 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.132 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 82.5 mt-10 56.85 34.77 25.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.933 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.2 mttm 76.02 1.2 3.44 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.406 -179.163 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.641 ' O ' HG23 ' A' ' 8' ' ' ILE . 41.5 t -100.31 156.18 4.19 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.617 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.57 ' HA ' HG13 ' A' ' 8' ' ' ILE . 94.1 p -98.19 149.0 23.02 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 121.427 0.632 . . . . 0.0 112.588 -178.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.476 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.16 -179.74 46.24 Favored Glycine 0 N--CA 1.449 -0.493 0 CA-C-N 114.653 -1.158 . . . . 0.0 110.313 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.65 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.59 141.54 21.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 117.615 0.707 . . . . 0.0 110.406 179.344 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.846 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.63 118.45 54.37 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.737 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 179.565 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.486 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -120.99 131.19 54.15 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.17 0.51 . . . . 0.0 111.546 -178.467 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.77 HG23 HD11 ' A' ' 42' ' ' LEU . 90.3 mt -106.08 138.57 30.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.056 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -131.32 117.18 18.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.149 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -93.63 4.93 53.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.189 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -79.12 -17.59 54.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.959 0.409 . . . . 0.0 110.318 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.22 141.22 17.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.873 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.484 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.0 t -114.28 116.33 44.33 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.825 179.893 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.484 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 1.2 Cg_endo -81.43 142.95 56.86 Favored 'Cis proline' 0 C--N 1.349 0.589 0 C-N-CA 123.807 -1.33 . . . . 0.0 111.934 0.102 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -45.33 141.64 2.47 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.142 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -136.59 167.15 21.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.158 0.504 . . . . 0.0 111.626 -179.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.846 HD21 HG12 ' A' ' 16' ' ' ILE . 5.1 tt -121.19 129.2 53.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.818 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.7 m -117.43 126.21 52.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.159 0.504 . . . . 0.0 112.177 -178.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.479 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 59.8 t90 -100.51 128.88 46.44 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.937 179.008 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 26.3 ttt180 -124.58 116.78 22.99 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.81 0.338 . . . . 0.0 111.069 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.476 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 16.3 m -46.11 168.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.125 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -42.07 61.72 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 121.48 0.657 . . . . 0.0 109.555 179.526 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -85.22 -20.19 30.52 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.832 -1.076 . . . . 0.0 111.03 179.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.01 33.26 11.09 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.513 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 51.9 t0 -100.55 -23.1 14.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.655 0.264 . . . . 0.0 111.425 -179.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.427 ' CE ' HG21 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -129.88 135.67 48.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.995 -179.947 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 12.7 p -139.12 130.32 34.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.143 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.507 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 15.8 t-80 -129.43 145.79 51.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.022 0.439 . . . . 0.0 111.291 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 46.1 m -129.07 135.05 48.39 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.965 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 98.7 t -126.26 140.87 47.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.161 0.505 . . . . 0.0 111.513 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.577 HG22 HG23 ' A' ' 44' ' ' THR . 2.1 p -85.51 117.55 30.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.113 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 1.058 HD13 HD13 ' A' ' 107' ' ' ILE . 72.5 mt -75.37 -29.66 59.96 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.995 -178.532 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.448 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 9.7 t -56.14 -21.71 24.22 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.225 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.577 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -96.8 -21.89 17.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.699 0.285 . . . . 0.0 111.186 -179.794 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.761 HD12 ' HB3' ' A' ' 62' ' ' LEU . 38.0 mm -56.64 90.59 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.049 0.452 . . . . 0.0 110.89 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -71.06 -27.25 63.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.604 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.74 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 20.7 mttm -144.74 152.39 40.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.013 0.435 . . . . 0.0 111.629 -179.399 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.621 HD23 ' HG2' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -132.69 131.13 40.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.988 179.345 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.403 ' O ' HD23 ' A' ' 60' ' ' LEU . 94.1 mt-30 -125.9 143.78 50.94 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.95 -179.452 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.603 ' HB1' ' CE ' ' A' ' 97' ' ' MET . . . -145.26 145.94 31.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.979 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.454 HG23 ' CE2' ' B' ' 54' ' ' PHE . 42.5 p -75.7 128.26 84.06 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.505 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -61.41 154.16 60.91 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.573 2.182 . . . . 0.0 112.467 -179.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.87 -40.51 97.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.173 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 85.3 p -59.44 -26.8 65.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.859 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 29.5 m -86.32 117.37 25.08 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.843 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -56.38 -18.65 11.67 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.596 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.8 mmtm -71.83 124.0 23.88 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.029 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 27.3 mmm -104.15 118.9 37.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.498 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.447 ' HE1' ' CE3' ' B' ' 53' ' ' TRP . 2.4 ttm -175.75 161.62 2.58 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.176 0.512 . . . . 0.0 112.006 -179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.403 HD23 ' O ' ' A' ' 49' ' ' GLN . 1.4 tt -153.59 123.94 7.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.756 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 29.8 ttp180 -117.94 138.03 52.44 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.761 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -112.44 136.17 52.26 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.259 179.291 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.74 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.3 mm -103.29 133.79 46.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.816 0.341 . . . . 0.0 111.142 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -101.93 134.07 11.61 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.076 179.437 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 40.1 mttt -44.1 137.5 3.35 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.942 0.401 . . . . 0.0 111.286 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.722 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.2 p -105.2 -162.13 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.009 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.722 ' H ' HG22 ' A' ' 66' ' ' VAL . 52.1 t0 -173.55 68.99 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.261 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -56.0 -22.21 25.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.398 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.4 m -58.2 -18.87 29.04 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.907 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.7 mtmt -69.57 -42.62 74.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.981 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.7 mttt 60.26 92.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.866 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -92.03 137.9 31.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.873 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 28.8 mmtm -89.16 145.29 25.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.897 0.38 . . . . 0.0 110.893 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -93.29 171.95 8.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.883 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 40.7 t-20 -59.43 -20.53 55.74 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.301 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 50.7 mp0 -86.41 3.44 43.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.359 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.07 14.29 82.05 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.709 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -110.08 144.43 38.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.909 0.385 . . . . 0.0 110.969 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -70.73 147.26 49.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.094 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.432 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.8 m -140.48 158.65 24.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.028 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 20.3 t -83.64 110.19 23.23 Favored Pre-proline 0 C--N 1.326 -0.444 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.403 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.432 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 86.1 Cg_exo -46.2 145.26 5.7 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.196 1.931 . . . . 0.0 112.622 -178.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.519 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 8.5 mmtm -83.09 99.3 0.64 Allowed Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.126 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.519 ' HD2' ' HA ' ' A' ' 83' ' ' LYS . 1.3 Cg_endo -40.77 149.61 0.16 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 123.433 2.755 . . . . 0.0 112.598 179.165 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -65.38 139.64 58.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.776 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 12.0 mtp180 -150.5 120.02 6.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.868 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -103.48 143.49 32.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.579 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 23.7 ttt -118.55 131.91 56.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.231 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.57 ' CE1' HD11 ' A' ' 16' ' ' ILE . 94.1 m-85 -139.2 144.39 38.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.645 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 1.5 m -125.17 135.1 52.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.074 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.833 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 2.1 m-85 -123.22 172.5 8.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.532 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 69.9 m-20 -126.74 26.9 6.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.005 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -157.3 121.77 4.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.607 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 32.9 mmt-85 -56.1 -36.18 67.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.026 0.441 . . . . 0.0 110.76 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.14 -55.17 15.32 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.919 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.522 HG13 ' CA ' ' A' ' 5' ' ' GLY . 55.3 t -61.13 -40.75 86.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.105 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.603 ' CE ' ' HB1' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -69.31 -34.78 75.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.312 179.628 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.47 ' O ' ' HG2' ' A' ' 101' ' ' LYS . 67.3 m-20 -76.14 -31.02 58.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.08 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -62.23 -36.27 81.46 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.313 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.519 HD12 ' CG2' ' A' ' 16' ' ' ILE . 22.1 mm -70.57 -49.15 54.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.957 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.555 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 4.4 pttt -64.8 -27.51 68.93 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.923 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.456 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.1 OUTLIER -78.55 -41.91 30.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.109 179.564 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.488 HG21 HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -71.4 -41.4 69.66 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.641 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.682 ' HA ' HD12 ' A' ' 107' ' ' ILE . 13.9 mt -60.31 -41.1 92.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.801 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.761 ' HA ' HD12 ' A' ' 108' ' ' ILE . 1.5 mt-30 -61.87 -30.23 70.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.939 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -68.48 -36.27 78.7 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.118 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.058 HD13 HD13 ' A' ' 42' ' ' LEU . 6.6 mt -70.72 -46.65 68.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.476 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.87 HG22 ' HD3' ' A' ' 112' ' ' LYS . 2.5 mt -57.48 -61.09 1.42 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 CA-C-O 121.803 0.811 . . . . 0.0 109.385 179.157 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.4 p -50.28 -31.71 14.98 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.199 -1.364 . . . . 0.0 110.91 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 52.5 mtt-85 -68.63 -33.53 74.17 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.832 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.508 ' CE2' HG22 ' A' ' 107' ' ' ILE . 20.1 m-85 -92.19 -33.92 14.51 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.921 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.87 ' HD3' HG22 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -65.02 -36.55 84.76 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.788 179.784 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -61.77 -37.02 82.75 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.936 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.06 -42.77 96.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.202 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 53.3 p30 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.945 -179.96 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 25.6 tp . . . . . 0 N--CA 1.485 1.312 0 CA-C-O 120.848 0.356 . . . . 0.0 111.295 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.7 m -124.61 164.21 32.06 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.831 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_exo -51.67 -43.24 52.15 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.577 2.185 . . . . 0.0 112.321 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -59.41 -28.0 66.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.964 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -62.24 -43.4 98.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.76 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 36.5 mm -67.69 -26.67 35.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.238 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -64.63 -33.79 76.75 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.933 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -32.91 74.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.671 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 53' ' ' TRP . . . . . 0.447 ' CE3' ' HE1' ' A' ' 59' ' ' MET . 11.4 m0 -57.26 -41.89 80.51 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.892 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 54' ' ' PHE . . . . . 0.454 ' CE2' HG23 ' A' ' 51' ' ' THR . 73.6 m-85 -68.0 -28.62 67.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.942 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -80.78 -38.32 28.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.855 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -59.72 139.99 56.83 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.898 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -141.03 163.44 42.33 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.914 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo . . . . . 0 C--O 1.25 1.101 0 C-N-CA 122.531 2.154 . . . . 0.0 112.287 179.949 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo . . . . . 0 N--CA 1.478 0.575 0 CA-C-O 120.791 0.246 . . . . 0.0 111.75 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.0 m -169.26 -60.96 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.951 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 64.2 m80 -126.43 33.27 5.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.15 0.5 . . . . 0.0 110.924 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.539 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 62.9 p 179.14 115.73 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.889 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.425 ' O ' ' C ' ' A' ' 6' ' ' ALA . . . -146.64 113.45 0.67 Allowed Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.929 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.552 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -32.93 120.09 0.34 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.769 0.319 . . . . 0.0 111.269 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.538 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -136.28 151.32 49.52 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -178.767 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.593 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.2 mp -98.54 125.36 51.92 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.27 0 CA-C-O 121.063 0.458 . . . . 0.0 110.523 179.29 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.504 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 7.4 t80 -117.05 130.13 56.47 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.015 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 58.58 33.81 23.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.814 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 69.8 mttt 75.46 1.6 3.66 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.149 -178.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.467 ' O ' HG23 ' A' ' 8' ' ' ILE . 31.3 t -101.44 148.4 7.34 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.745 0 CA-C-N 116.031 -0.532 . . . . 0.0 109.63 179.055 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.593 ' HA ' HG13 ' A' ' 8' ' ' ILE . 78.7 p -86.83 146.21 26.3 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-O 121.446 0.641 . . . . 0.0 111.523 -179.368 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.444 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . -175.6 -179.1 45.92 Favored Glycine 0 N--CA 1.441 -0.984 0 CA-C-N 115.056 -0.975 . . . . 0.0 111.764 -179.528 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.552 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 7.0 mm -106.21 136.01 42.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 120.849 0.357 . . . . 0.0 110.062 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.695 HG12 HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -106.6 117.85 53.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.836 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.475 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -123.61 132.13 53.79 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.337 0.589 . . . . 0.0 111.596 -178.049 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.469 HD13 HG22 ' A' ' 103' ' ' THR . 46.1 mt -102.46 133.0 47.36 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.058 -179.409 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -124.35 114.18 19.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.012 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -88.35 5.61 41.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.251 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -78.37 -18.23 55.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.911 0.386 . . . . 0.0 110.358 179.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -98.07 145.43 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.904 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.413 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 1.2 t -121.81 116.25 30.37 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.991 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.489 ' HG2' HG23 ' A' ' 41' ' ' VAL . 72.1 Cg_endo -76.22 149.79 92.35 Favored 'Cis proline' 0 C--N 1.35 0.612 0 C-N-CA 123.211 -1.579 . . . . 0.0 112.108 -0.043 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.14 137.56 5.96 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.801 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -128.35 164.18 23.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.148 0.499 . . . . 0.0 111.803 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.695 HD21 HG12 ' A' ' 16' ' ' ILE . 4.8 tt -121.12 129.19 53.18 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.696 179.262 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.0 m -116.5 129.0 55.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.137 0.494 . . . . 0.0 111.902 -179.043 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.499 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 57.8 t90 -100.37 125.68 46.66 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.139 179.083 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.19 116.51 23.52 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.638 179.731 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.403 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 11.2 m -44.42 158.36 0.05 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.704 0.288 . . . . 0.0 110.975 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.425 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -66.34 -39.45 89.22 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.494 0.664 . . . . 0.0 109.263 179.974 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 48.0 p30 -85.51 -20.8 29.13 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.213 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.77 32.71 12.4 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.649 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -99.5 -23.56 15.06 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.839 0.352 . . . . 0.0 111.467 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.3 mtmt -130.12 142.42 50.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.07 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 14.4 p -139.04 136.71 42.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.22 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.504 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 35.2 t-80 -136.39 146.34 46.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.007 0.432 . . . . 0.0 111.347 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 43.5 m -127.47 136.95 52.5 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.951 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 92.6 t -132.38 140.87 46.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-O 121.018 0.437 . . . . 0.0 111.599 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.682 HG13 ' CG2' ' A' ' 44' ' ' THR . 0.8 OUTLIER -87.75 118.15 32.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 178.026 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 1.043 HD13 HD13 ' A' ' 107' ' ' ILE . 46.6 mt -71.61 -29.7 64.97 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -178.235 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.455 ' CB ' ' HB2' ' A' ' 24' ' ' PRO . 1.5 t -55.51 -22.22 20.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.671 0.272 . . . . 0.0 111.684 -179.39 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.682 ' CG2' HG13 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -88.69 -24.96 22.6 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.786 0.327 . . . . 0.0 111.252 -179.653 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.79 HD12 ' HB3' ' A' ' 62' ' ' LEU . 50.5 mm -56.04 91.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.064 0.459 . . . . 0.0 111.021 -179.745 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 63' ' ' ILE . 7.1 t0 -78.59 -25.82 45.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.598 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.408 ' HB2' HG13 ' A' ' 63' ' ' ILE . 7.2 mmmt -148.32 148.59 30.58 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.053 0.454 . . . . 0.0 111.518 -179.558 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.775 HD11 ' HB3' ' A' ' 104' ' ' LEU . 41.2 mt -115.68 124.37 50.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.498 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -115.15 137.84 51.57 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.76 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.739 ' HB2' ' CD1' ' A' ' 60' ' ' LEU . . . -145.89 151.27 37.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.014 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 55.1 p -75.72 130.31 79.3 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.58 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.32 158.46 44.64 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.583 2.189 . . . . 0.0 112.489 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.59 -43.0 97.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.066 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.1 m -59.35 -27.59 66.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.072 0.463 . . . . 0.0 110.822 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 31.5 t -82.31 119.55 24.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.896 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -57.18 -18.27 14.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.44 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.404 ' HD2' ' CE3' ' B' ' 53' ' ' TRP . 35.8 mmtm -60.45 155.85 17.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.854 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 17.3 mtp -143.02 79.9 1.66 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.794 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.429 ' CE ' ' CE3' ' B' ' 53' ' ' TRP . 0.2 OUTLIER -147.55 167.22 25.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.061 0.458 . . . . 0.0 111.63 -179.669 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.739 ' CD1' ' HB2' ' A' ' 50' ' ' ALA . 13.2 tp -136.46 128.66 29.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.034 179.458 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -114.26 122.03 45.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.945 0.402 . . . . 0.0 111.788 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.79 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.3 OUTLIER -97.24 139.6 32.97 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.924 179.014 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.507 HD13 ' HG2' ' A' ' 86' ' ' ARG . 0.9 OUTLIER -115.66 119.22 61.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.017 -179.686 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -89.49 151.77 22.13 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.248 179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.8 mttm -59.06 135.51 57.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.805 0.336 . . . . 0.0 110.762 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.786 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.3 p -79.62 -167.55 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.169 0.509 . . . . 0.0 111.193 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.786 ' H ' HG22 ' A' ' 66' ' ' VAL . 54.2 p-10 -148.44 59.51 1.08 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.638 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -56.01 -22.55 27.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.387 -179.553 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.4 t -59.62 -17.52 34.07 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.015 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.8 mmtp -71.01 -50.68 31.51 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.761 0.315 . . . . 0.0 111.092 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.4 mmtm 63.43 95.22 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.712 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 31.6 mmt180 -99.65 168.64 9.8 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.804 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 7.9 mttt -124.91 146.69 49.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.96 0.409 . . . . 0.0 111.08 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -86.28 171.93 10.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.8 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -62.15 -18.11 59.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.343 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -85.95 4.38 37.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.569 0.223 . . . . 0.0 111.425 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 83.54 3.22 89.87 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.78 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.402 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 24.2 p30 -91.26 168.14 11.81 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.738 0.304 . . . . 0.0 110.763 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -94.89 153.38 17.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.851 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.44 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.2 m -138.18 158.9 32.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.969 0.414 . . . . 0.0 111.222 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 38.5 t -101.93 98.74 10.52 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.563 178.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.44 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 93.5 Cg_exo -42.81 145.34 1.12 Allowed 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.537 2.158 . . . . 0.0 112.779 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.449 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 11.4 mttp -84.35 148.58 53.01 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.054 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.578 ' HA ' HG23 ' A' ' 66' ' ' VAL . 16.4 Cg_exo -73.06 162.4 40.96 Favored 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 123.509 2.806 . . . . 0.0 112.741 -178.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -65.45 144.03 57.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.802 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.507 ' HG2' HD13 ' A' ' 63' ' ' ILE . 32.9 mtp180 -145.12 119.92 9.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.935 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 58.2 m-70 -107.4 159.11 16.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.61 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.1 ttt -130.44 132.03 45.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.029 0.442 . . . . 0.0 111.345 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.663 ' CE2' HD11 ' A' ' 16' ' ' ILE . 87.6 m-85 -138.62 145.99 41.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.459 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -118.96 133.87 55.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.809 0.338 . . . . 0.0 111.1 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.502 ' N ' ' CD1' ' A' ' 91' ' ' PHE . 1.4 m-85 -127.5 158.24 37.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.573 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 53.5 m-20 -115.79 25.53 10.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.936 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.478 ' HB3' HG23 ' A' ' 96' ' ' VAL . 47.3 t-20 -156.68 108.03 2.42 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.487 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 8.9 tpp180 -46.86 -29.87 2.21 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.005 0.431 . . . . 0.0 111.288 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.2 -54.0 9.54 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.537 -179.738 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.478 HG23 ' HB3' ' A' ' 93' ' ' ASN . 58.1 t -53.63 -49.66 54.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.827 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.432 ' HB3' ' CG ' ' A' ' 91' ' ' PHE . 18.7 ptm -63.98 -37.22 86.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.0 0.429 . . . . 0.0 110.064 179.386 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -66.38 -31.2 71.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.511 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -67.89 -40.46 83.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.931 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.67 HG22 HD12 ' A' ' 104' ' ' LEU . 24.7 mm -66.43 -49.77 72.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.423 179.273 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 3.9 pttt -66.01 -27.28 68.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.46 179.525 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 64.6 mtp -78.25 -40.19 37.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.542 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.469 HG22 HD13 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -79.11 -37.18 39.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.514 179.735 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.807 ' HA ' HD12 ' A' ' 107' ' ' ILE . 12.0 mt -61.59 -39.56 91.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.767 179.711 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.756 ' HA ' HD12 ' A' ' 108' ' ' ILE . 1.0 OUTLIER -61.65 -29.1 69.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.878 179.874 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 99.6 mm-40 -69.23 -33.8 73.83 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.811 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.043 HD13 HD13 ' A' ' 42' ' ' LEU . 4.0 mt -72.52 -44.48 61.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.308 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.87 HG22 ' HD3' ' A' ' 112' ' ' LYS . 2.6 mt -58.84 -61.18 1.52 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.551 0 CA-C-O 121.764 0.792 . . . . 0.0 109.474 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.1 t -50.91 -28.84 10.51 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.16 -1.382 . . . . 0.0 110.943 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 49.3 mtt180 -70.32 -33.7 71.82 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.762 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.477 ' CE2' HG22 ' A' ' 107' ' ' ILE . 19.9 m-85 -92.32 -35.33 13.8 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.938 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.87 ' HD3' HG22 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -63.68 -40.53 97.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.741 179.802 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -60.34 -37.13 79.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.878 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.73 -32.93 74.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.068 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 43.1 t0 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.163 -0.922 . . . . 0.0 111.277 179.824 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 45' ' ' LEU . . . . . 0.502 HD23 ' O ' ' B' ' 45' ' ' LEU . 7.0 tt . . . . . 0 N--CA 1.485 1.304 0 CA-C-O 120.83 0.347 . . . . 0.0 111.226 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 5.7 t -124.47 152.2 68.06 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.751 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -48.6 -39.86 37.58 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.606 2.204 . . . . 0.0 112.324 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -62.06 -27.14 68.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.696 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -64.75 -45.62 85.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.861 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 31.2 mm -66.33 -26.67 38.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.215 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -65.47 -33.73 76.63 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.915 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.36 -28.56 67.23 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.204 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 53' ' ' TRP . . . . . 0.429 ' CE3' ' CE ' ' A' ' 59' ' ' MET . 11.5 m0 -54.26 -29.2 46.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.842 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 54' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -97.51 -24.94 15.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.976 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -81.07 -29.65 34.91 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.793 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 45.0 -166.39 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.367 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -123.46 78.41 54.39 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.901 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo . . . . . 0 C--O 1.249 1.037 0 C-N-CA 122.507 2.138 . . . . 0.0 112.313 -179.999 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo . . . . . 0 N--CA 1.477 0.512 0 CA-C-O 120.801 0.25 . . . . 0.0 111.862 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.2 t 61.22 -83.08 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.163 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.449 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 55.1 m80 -117.37 37.9 3.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.982 0.42 . . . . 0.0 111.265 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.521 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 1.2 m -166.68 176.62 7.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.671 179.258 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 159.08 126.09 0.84 Allowed Glycine 0 N--CA 1.444 -0.814 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.321 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.606 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -53.65 111.65 0.77 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.018 0.437 . . . . 0.0 111.192 -179.689 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.631 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -125.81 150.27 47.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.831 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.551 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -100.14 125.78 53.8 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.267 0 CA-C-O 120.979 0.418 . . . . 0.0 110.222 179.049 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.507 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 6.1 t80 -112.93 131.16 55.85 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.284 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.0 mt-10 55.07 34.25 22.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.859 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.0 mttp 76.44 0.8 3.26 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.365 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.527 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.4 t -98.78 154.25 4.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 178.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.551 ' HA ' HG13 ' A' ' 8' ' ' ILE . 83.6 p -96.32 149.0 22.17 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 121.721 0.772 . . . . 0.0 112.742 -178.421 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.469 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.7 -179.69 46.72 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 114.449 -1.25 . . . . 0.0 110.292 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.606 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.71 144.35 15.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 117.673 0.736 . . . . 0.0 110.529 179.36 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.825 HG12 HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -106.81 118.55 54.77 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 CA-C-N 115.358 -0.837 . . . . 0.0 108.835 179.577 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.521 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -121.14 132.31 54.78 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.355 -178.689 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.514 ' CG1' HD12 ' A' ' 27' ' ' LEU . 59.3 mt -104.08 140.1 23.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.074 -179.163 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -132.51 111.46 11.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.862 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -90.36 5.2 48.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.325 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -78.9 -17.76 55.02 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.954 0.406 . . . . 0.0 110.36 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.62 142.97 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.947 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.426 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.5 t -115.81 116.77 40.47 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.834 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.426 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 2.1 Cg_endo -80.08 144.65 69.92 Favored 'Cis proline' 0 C--N 1.348 0.534 0 C-N-CA 123.707 -1.372 . . . . 0.0 111.933 0.142 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.78 139.58 5.25 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.886 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -133.49 167.27 20.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.088 0.47 . . . . 0.0 111.661 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.825 HD21 HG12 ' A' ' 16' ' ' ILE . 5.6 tt -120.97 128.78 53.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.639 179.348 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.3 m -114.74 127.48 55.77 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.208 0.528 . . . . 0.0 112.085 -178.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.496 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 56.3 t90 -100.43 128.8 46.39 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.8 179.029 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 14.6 tpt180 -123.51 116.04 22.52 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.79 0.329 . . . . 0.0 110.976 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.469 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 30.9 t -45.37 164.36 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.062 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.41 -41.56 66.12 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.482 0.658 . . . . 0.0 109.507 179.653 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -82.32 -22.17 35.72 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.792 -1.094 . . . . 0.0 111.027 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.72 32.99 10.42 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.458 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -106.82 -20.18 13.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.712 0.291 . . . . 0.0 111.433 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.487 ' HE2' HG21 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -129.46 135.0 48.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.799 0.333 . . . . 0.0 111.109 -179.814 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 13.2 p -139.15 138.93 40.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.042 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.507 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 34.7 t-80 -136.81 146.24 45.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.082 0.468 . . . . 0.0 111.364 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 48.2 m -127.15 132.77 50.46 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.073 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 95.7 t -124.32 140.87 46.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.457 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.61 HG22 HG23 ' A' ' 44' ' ' THR . 2.1 p -85.2 117.33 30.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 178.1 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 1.031 HD13 HD13 ' A' ' 107' ' ' ILE . 68.5 mt -75.7 -30.42 59.33 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.124 -178.538 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.409 ' HB3' ' HB3' ' A' ' 24' ' ' PRO . 60.5 p -56.12 -21.74 24.2 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -179.004 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.61 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -93.91 -24.73 17.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.742 0.306 . . . . 0.0 111.287 -179.704 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.829 HD12 ' HB3' ' A' ' 62' ' ' LEU . 42.7 mm -51.17 93.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.983 0.421 . . . . 0.0 110.918 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -77.54 -27.68 51.7 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.511 -179.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.61 ' CE ' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -140.3 159.15 42.83 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 121.201 0.524 . . . . 0.0 111.381 -179.298 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.748 HD11 ' HB3' ' A' ' 104' ' ' LEU . 27.4 mt -126.89 124.24 39.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.953 178.683 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.432 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 79.9 mt-30 -120.81 136.9 54.78 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.977 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.402 ' HB2' ' HG ' ' A' ' 60' ' ' LEU . . . -148.23 151.23 35.12 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.115 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 60.5 p -75.56 126.82 87.01 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.44 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -59.51 155.85 39.61 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.55 2.167 . . . . 0.0 112.515 -179.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.48 -43.08 97.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.091 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 93.6 p -59.59 -27.62 66.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.038 0.447 . . . . 0.0 110.722 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 26.3 t -80.62 120.9 25.16 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.954 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -56.65 -18.48 12.35 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.334 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.416 ' HD2' ' CE3' ' B' ' 53' ' ' TRP . 30.4 mmtt -66.79 156.49 35.38 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.872 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.496 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 31.7 mtp -143.0 89.89 2.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.743 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.466 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 44.3 mtm -155.74 156.36 34.72 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.052 0.453 . . . . 0.0 111.817 -179.65 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.553 HD11 ' HD2' ' A' ' 101' ' ' LYS . 0.1 OUTLIER -131.61 123.9 28.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.38 179.707 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.432 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 39.0 mtp180 -107.82 127.08 53.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.847 0.355 . . . . 0.0 111.333 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.829 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -111.04 123.45 50.22 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.943 -179.929 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.61 HD13 ' CE ' ' A' ' 47' ' ' LYS . 3.9 mp -109.64 136.04 46.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.831 0.348 . . . . 0.0 111.136 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.9 -169.42 38.21 Favored Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.378 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.91 143.43 34.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.759 0.314 . . . . 0.0 110.807 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.747 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.3 p -99.97 -162.25 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.045 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.747 ' H ' HG22 ' A' ' 66' ' ' VAL . 14.3 t70 -175.14 70.97 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.254 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.558 ' OE1' HG12 ' A' ' 81' ' ' VAL . 52.7 mm-40 -56.9 -20.61 24.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.492 -179.486 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 27.1 t -57.51 -18.59 19.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.206 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.3 mmmt -57.76 -46.77 84.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.068 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? 62.29 94.32 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.856 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 57.7 mmm-85 -107.64 154.92 20.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.822 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -119.11 145.33 46.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.908 0.385 . . . . 0.0 111.041 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -84.85 171.27 12.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.865 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -61.97 -18.09 59.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.384 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -85.41 4.67 34.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.551 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 81.61 6.57 89.02 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.722 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -94.23 162.07 14.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.707 0.289 . . . . 0.0 110.681 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -94.97 151.83 18.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.938 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.459 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.3 m -135.41 158.93 40.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.15 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.558 HG12 ' OE1' ' A' ' 68' ' ' GLU . 19.4 t -101.05 98.73 9.13 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.708 178.774 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.459 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 92.1 Cg_exo -42.81 145.52 1.07 Allowed 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.562 2.175 . . . . 0.0 112.845 -179.005 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.411 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 2.6 tttt -104.48 150.84 38.93 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.715 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 16.9 Cg_exo -72.43 147.14 46.09 Favored 'Trans proline' 0 N--CA 1.464 -0.207 0 C-N-CA 123.524 2.816 . . . . 0.0 112.699 -178.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -65.63 133.73 51.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.905 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.52 ' HG2' ' CG1' ' A' ' 63' ' ' ILE . 10.4 mtm180 -123.94 124.43 42.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.767 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -93.49 159.15 15.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.554 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 25.4 ttt -133.45 128.99 36.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.87 0.367 . . . . 0.0 111.381 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.623 ' CE1' HD11 ' A' ' 16' ' ' ILE . 97.9 m-85 -139.68 148.99 43.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.603 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.466 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 2.8 t -125.64 124.17 40.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.841 0.353 . . . . 0.0 110.937 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.631 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 3.8 m-85 -112.44 170.61 8.05 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.914 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.496 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 27.7 p30 -128.76 26.09 5.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.146 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.459 ' ND2' ' O ' ' A' ' 92' ' ' ASN . 26.0 m120 -153.53 112.05 3.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.65 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.71 -33.0 63.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.208 0.528 . . . . 0.0 110.902 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.19 -49.64 54.81 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.162 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.4 HG23 ' CB ' ' A' ' 93' ' ' ASN . 47.9 t -58.89 -40.64 80.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.556 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.438 ' SD ' HD12 ' A' ' 60' ' ' LEU . 0.6 OUTLIER -63.48 -33.56 75.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.431 179.508 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -65.44 -35.4 80.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.741 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -69.28 -41.19 77.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.806 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.445 HG22 HD12 ' A' ' 104' ' ' LEU . 21.5 mm -62.76 -52.02 64.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.738 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.553 ' HD2' HD11 ' A' ' 60' ' ' LEU . 5.6 mtpp -64.55 -27.87 69.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.723 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 36.3 mtm -78.42 -36.88 45.06 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.062 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.512 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.5 OUTLIER -82.06 -38.96 24.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.009 -179.792 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.836 ' CD2' HD22 ' A' ' 42' ' ' LEU . 16.2 mt -64.08 -39.67 94.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.841 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.711 ' HA ' HD12 ' A' ' 108' ' ' ILE . 2.3 mt-30 -64.46 -29.34 70.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.865 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -69.37 -31.64 70.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.921 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.031 HD13 HD13 ' A' ' 42' ' ' LEU . 5.9 mt -74.89 -46.43 40.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.282 -179.87 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.711 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.2 mt -58.22 -61.24 1.44 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.589 0 CA-C-O 121.689 0.757 . . . . 0.0 109.343 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.5 m -50.53 -28.91 9.39 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.325 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.92 -41.56 97.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.449 179.392 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 75.5 m-85 -83.64 -29.65 27.51 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.344 179.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.473 ' CE ' HG22 ' A' ' 108' ' ' ILE . 18.9 mttt -63.03 -43.3 99.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.502 179.455 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -59.34 -38.05 79.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.859 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.41 -32.59 74.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.134 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 51.9 t0 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.328 -0.844 . . . . 0.0 110.893 179.99 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 45' ' ' LEU . . . . . 0.655 HD13 ' N ' ' B' ' 45' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.838 0.351 . . . . 0.0 111.341 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.1 m -130.1 167.49 20.49 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.912 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -50.74 -46.22 31.28 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.572 2.182 . . . . 0.0 112.487 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -63.49 -31.74 72.98 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.895 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -64.88 -40.97 95.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.893 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 35.2 mm -68.12 -24.24 29.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.363 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -63.17 -35.55 80.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.827 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 52' ' ' GLN . . . . . 0.433 ' HG2' ' CD1' ' B' ' 53' ' ' TRP . 4.9 pt20 -58.19 -41.27 83.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.13 0.49 . . . . 0.0 110.872 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 53' ' ' TRP . . . . . 0.433 ' CD1' ' HG2' ' B' ' 52' ' ' GLN . 47.9 m95 -56.62 -29.92 62.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.112 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 54' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -108.15 -0.7 20.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.205 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -99.05 -29.7 12.74 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 120.706 0.289 . . . . 0.0 110.945 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -58.98 139.62 56.57 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.994 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -142.08 164.92 30.8 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.855 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo . . . . . 0 C--O 1.248 1.019 0 C-N-CA 122.54 2.16 . . . . 0.0 112.282 -179.98 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo . . . . . 0 N--CA 1.476 0.469 0 CA-C-O 120.857 0.274 . . . . 0.0 111.817 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.0 t 60.75 112.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.932 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 52.8 m80 62.19 32.6 17.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.218 0.533 . . . . 0.0 110.876 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.589 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 75.1 p 178.11 162.41 0.63 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.572 179.177 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.419 ' CA ' HG13 ' A' ' 96' ' ' VAL . . . 161.6 116.27 0.39 Allowed Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.716 -0.755 . . . . 0.0 112.535 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.639 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -46.88 102.87 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.104 0.478 . . . . 0.0 111.298 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.823 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -117.64 151.79 36.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.931 -178.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.556 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.9 OUTLIER -98.78 123.88 51.65 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.26 0 CA-C-O 121.101 0.477 . . . . 0.0 110.373 178.918 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.504 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 14.3 t80 -112.26 130.17 56.02 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.045 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 56.52 34.35 24.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.731 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.8 mtpm? 75.88 1.7 3.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.287 -179.072 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.511 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.8 t -100.8 154.57 4.56 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.596 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.001 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.556 ' HA ' HG13 ' A' ' 8' ' ' ILE . 89.5 p -95.66 149.42 21.48 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 121.549 0.69 . . . . 0.0 112.646 -178.594 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.465 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 174.54 -179.73 45.68 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 114.645 -1.161 . . . . 0.0 110.41 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.639 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.83 141.91 20.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 117.795 0.797 . . . . 0.0 110.579 179.426 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.865 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.77 118.48 54.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 179.62 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.5 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -121.83 130.44 53.39 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.525 -178.496 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.862 HG23 HD11 ' A' ' 42' ' ' LEU . 77.2 mt -101.45 129.7 52.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.12 -179.526 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 51.6 t30 -116.1 111.44 20.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.034 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -89.75 7.03 38.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.165 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -78.94 -18.47 53.74 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.852 0.358 . . . . 0.0 110.384 179.369 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.502 ' CG2' ' N ' ' A' ' 23' ' ' SER . 0.5 OUTLIER -100.19 159.77 3.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.892 -179.961 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.502 ' N ' ' CG2' ' A' ' 22' ' ' VAL . 2.0 t -131.04 117.11 16.98 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.04 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.449 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 71.8 Cg_endo -77.12 147.48 85.89 Favored 'Cis proline' 0 C--N 1.349 0.581 0 C-N-CA 123.36 -1.517 . . . . 0.0 112.188 0.004 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.22 136.51 9.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.727 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -128.07 166.89 17.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.222 0.534 . . . . 0.0 111.673 -179.178 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.865 HD21 HG12 ' A' ' 16' ' ' ILE . 5.0 tt -121.27 132.97 55.12 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.852 179.411 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 49.8 m -119.68 126.95 52.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.155 0.502 . . . . 0.0 112.031 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.482 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 57.9 t90 -100.58 130.31 46.62 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.884 179.116 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 24.4 tpt85 -125.25 114.99 19.67 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.837 0.351 . . . . 0.0 110.725 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.465 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 72.5 p -45.47 165.37 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.06 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.59 -42.35 58.87 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.481 0.658 . . . . 0.0 109.795 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -78.55 -22.74 46.78 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.101 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.52 33.44 10.27 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.381 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -111.36 -18.67 12.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.56 0.219 . . . . 0.0 111.588 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.506 ' NZ ' HG21 ' A' ' 12' ' ' VAL . 6.3 mtmt -128.65 134.57 48.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.909 0.385 . . . . 0.0 111.187 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 11.0 p -139.26 141.83 34.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.038 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.504 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 23.8 t-80 -137.6 146.1 43.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.125 0.488 . . . . 0.0 111.286 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 37.2 m -127.74 135.11 49.7 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.97 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.6 t -130.72 140.86 47.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 121.008 0.432 . . . . 0.0 111.548 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.772 HG13 ' CG2' ' A' ' 44' ' ' THR . 1.3 p -86.37 118.11 32.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.178 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 1.013 HD13 HD13 ' A' ' 107' ' ' ILE . 63.9 mt -70.89 -31.2 67.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.239 -0.437 . . . . 0.0 112.159 -178.34 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.439 ' CB ' ' HB2' ' A' ' 24' ' ' PRO . 2.0 t -52.67 -23.79 7.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.759 0.314 . . . . 0.0 111.543 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.772 ' CG2' HG13 ' A' ' 41' ' ' VAL . 0.2 OUTLIER -86.25 -25.94 25.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.092 -179.866 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.527 HG12 ' HA ' ' A' ' 42' ' ' LEU . 41.6 mm -49.62 98.8 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.045 0.45 . . . . 0.0 111.116 -179.627 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -94.22 -21.01 19.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.583 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.408 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 61.2 mttm -156.61 137.68 13.61 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.976 0.417 . . . . 0.0 111.362 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.707 HD11 ' HB3' ' A' ' 104' ' ' LEU . 60.0 mt -109.37 124.26 50.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.595 179.431 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.448 ' HG3' ' CD1' ' B' ' 54' ' ' PHE . 4.8 tp60 -109.66 130.93 55.47 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.55 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.527 ' HB3' ' NZ ' ' A' ' 101' ' ' LYS . . . -141.87 140.79 32.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.192 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.465 HG23 ' O ' ' A' ' 59' ' ' MET . 71.3 p -75.7 124.0 88.59 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.523 179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -61.51 160.31 28.43 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.578 2.185 . . . . 0.0 112.598 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.58 -42.97 97.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.095 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 86.2 p -60.26 -27.66 67.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.041 0.448 . . . . 0.0 110.603 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 28.7 t -81.22 119.9 24.2 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.806 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.1 tp10 -55.88 -18.86 9.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.386 179.232 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.1 mmtt -60.42 151.62 27.65 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.895 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.462 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 45.6 mtp -143.14 89.46 2.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.606 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.465 ' O ' HG23 ' A' ' 51' ' ' THR . 3.0 tmm? -172.85 147.22 1.67 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.001 0.429 . . . . 0.0 111.469 -179.558 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.741 HD11 ' HB2' ' A' ' 101' ' ' LYS . 0.4 OUTLIER -114.39 134.53 54.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.309 179.687 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.446 ' HB2' ' CZ ' ' B' ' 54' ' ' PHE . 0.5 OUTLIER -120.82 124.22 44.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.036 0.446 . . . . 0.0 111.742 -179.519 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.5 HD11 HD23 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -94.89 144.14 25.9 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.433 179.386 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.558 HD13 ' HG2' ' A' ' 86' ' ' ARG . 1.2 mm -118.27 124.01 72.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.019 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -92.17 154.53 22.42 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.534 -0.841 . . . . 0.0 112.367 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 37.3 mttt -67.75 155.56 39.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.837 0.351 . . . . 0.0 110.851 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.72 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.3 p -121.16 -162.31 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.996 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.72 ' H ' HG22 ' A' ' 66' ' ' VAL . 40.6 t0 -177.67 71.11 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.234 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.672 ' HB3' HG23 ' A' ' 81' ' ' VAL . 82.0 mt-10 -55.13 -23.38 20.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.341 -179.391 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.9 m -62.93 -15.04 53.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.935 179.615 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.3 mmtt -66.81 -43.86 82.75 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.709 0.29 . . . . 0.0 111.038 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.4 mptt 60.67 93.09 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.781 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.434 ' HD2' HG22 ' A' ' 80' ' ' VAL . 0.0 OUTLIER -104.47 137.91 41.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.87 -179.812 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.9 mmtp -83.7 145.33 28.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.088 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.472 ' CG ' HG11 ' A' ' 80' ' ' VAL . 9.0 m-20 -88.02 176.82 7.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.975 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -67.01 -15.99 64.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.404 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -88.38 -7.9 55.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.242 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 94.37 9.27 59.25 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.626 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -103.29 145.7 29.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.791 0.329 . . . . 0.0 110.864 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -78.4 140.87 38.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.963 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.472 HG11 ' CG ' ' A' ' 74' ' ' ASP . 1.3 m -140.56 152.63 21.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.191 0.52 . . . . 0.0 111.387 -179.785 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.672 HG23 ' HB3' ' A' ' 68' ' ' GLU . 2.3 p -85.29 109.03 18.17 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.554 178.826 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.444 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 52.2 Cg_exo -53.22 145.55 43.4 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.128 1.885 . . . . 0.0 112.483 -178.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 2.9 mmpt? -89.97 154.52 47.52 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.997 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 19.2 Cg_exo -71.48 144.26 44.76 Favored 'Trans proline' 0 N--CA 1.465 -0.189 0 C-N-CA 123.514 2.81 . . . . 0.0 112.685 -178.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -66.43 141.93 57.76 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.97 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.558 ' HG2' HD13 ' A' ' 63' ' ' ILE . 16.9 mtm180 -144.78 120.0 10.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.651 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.422 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 68.3 m-70 -109.55 159.05 17.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.538 179.813 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.567 ' SD ' HG21 ' B' ' 50' ' ' ILE . 13.7 ttt -133.62 139.96 46.82 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.076 0.465 . . . . 0.0 111.401 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.639 ' CE2' HD11 ' A' ' 16' ' ' ILE . 91.7 m-85 -148.71 125.35 11.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.146 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 27.0 t -101.63 134.52 44.64 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.967 0.413 . . . . 0.0 111.542 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.823 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 2.2 m-85 -123.37 130.3 52.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.583 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.462 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 12.9 m120 -74.3 -18.57 60.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.353 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.527 ' HB2' HG23 ' A' ' 96' ' ' VAL . 96.8 m-20 -114.51 114.36 25.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.827 0.346 . . . . 0.0 110.825 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.94 -26.64 26.46 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.057 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.14 -46.04 62.34 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.255 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.527 HG23 ' HB2' ' A' ' 93' ' ' ASN . 61.4 t -58.49 -52.36 60.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.622 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.458 ' HB3' ' CG ' ' A' ' 91' ' ' PHE . 9.8 ptm -60.24 -32.35 71.06 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.418 ' O ' ' HE2' ' A' ' 102' ' ' MET . 47.3 t0 -61.55 -35.02 76.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.388 179.397 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.437 ' O ' ' HB ' ' A' ' 103' ' ' THR . 25.6 m120 -71.66 -44.42 64.34 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.459 179.504 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.581 HG22 HD12 ' A' ' 104' ' ' LEU . 23.2 mm -60.53 -52.1 65.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.14 0.495 . . . . 0.0 110.679 179.437 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.741 ' HB2' HD11 ' A' ' 60' ' ' LEU . 1.3 ttmt -62.2 -30.88 71.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.799 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.418 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 41.8 mtm -78.56 -40.45 34.76 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.855 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.437 ' HB ' ' O ' ' A' ' 99' ' ' ASN . 0.6 OUTLIER -76.06 -42.99 45.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.874 -179.879 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.757 ' CD2' HD22 ' A' ' 42' ' ' LEU . 18.0 mt -60.73 -37.07 80.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.772 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.748 ' HA ' HD12 ' A' ' 108' ' ' ILE . 1.1 mm-40 -63.43 -29.75 70.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.836 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -67.4 -37.1 82.57 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.972 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.013 HD13 HD13 ' A' ' 42' ' ' LEU . 3.5 mt -68.51 -44.08 83.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.294 -179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.914 HG22 ' CD ' ' A' ' 112' ' ' LYS . 2.5 mt -60.83 -61.21 1.66 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.589 0 CA-C-O 121.847 0.832 . . . . 0.0 109.393 179.08 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 27.5 m -53.27 -28.85 29.9 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.172 -1.376 . . . . 0.0 110.853 179.369 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 51.4 mtt-85 -72.45 -33.74 67.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.666 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.452 ' CE2' ' CG2' ' A' ' 107' ' ' ILE . 22.3 m-30 -87.99 -31.12 19.52 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.842 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.914 ' CD ' HG22 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -62.95 -35.37 79.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.045 0.45 . . . . 0.0 110.64 179.637 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -58.28 -37.09 74.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.939 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.25 -33.54 74.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.138 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.312 -0.852 . . . . 0.0 110.871 179.968 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 26.5 tp . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.849 0.357 . . . . 0.0 111.171 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.6 m -126.99 166.29 23.47 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.923 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_exo -51.31 -44.78 41.13 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.583 2.189 . . . . 0.0 112.325 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -58.9 -29.98 67.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.798 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -62.65 -41.2 98.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.719 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.567 HG21 ' SD ' ' A' ' 88' ' ' MET . 34.3 mm -67.09 -27.77 40.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.305 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.04 -32.04 73.55 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.787 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -28.55 68.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.815 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 53' ' ' TRP . . . . . . . . . . . . . 12.8 m0 -55.98 -40.91 73.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.014 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 54' ' ' PHE . . . . . 0.448 ' CD1' ' HG3' ' A' ' 49' ' ' GLN . 98.0 m-85 -84.92 -24.24 28.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.017 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -76.5 -43.35 39.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.929 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -62.92 136.06 57.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.034 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -136.39 76.11 50.43 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.809 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo . . . . . 0 C--O 1.249 1.067 0 C-N-CA 122.595 2.197 . . . . 0.0 112.32 179.887 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo . . . . . 0 N--CA 1.477 0.513 0 CA-C-O 120.853 0.272 . . . . 0.0 111.821 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.4 t 57.32 103.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.887 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 78.0 m80 63.59 32.68 13.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.244 0.545 . . . . 0.0 111.039 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.653 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 80.6 p 178.47 172.99 0.7 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.688 178.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.412 ' CA ' ' CG1' ' A' ' 96' ' ' VAL . . . 153.17 117.2 0.67 Allowed Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.028 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.589 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -39.82 117.85 0.8 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.897 0.379 . . . . 0.0 111.224 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.654 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -134.47 152.03 51.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.738 -179.114 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.6 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.2 mp -98.39 126.69 51.41 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.263 0 CA-C-O 121.138 0.494 . . . . 0.0 110.78 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.507 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 9.5 t80 -118.82 128.66 54.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.724 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.439 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 82.4 mt-10 59.02 36.79 24.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.595 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.439 ' HB2' ' O ' ' A' ' 10' ' ' GLU . 1.6 mtmt 72.13 2.43 4.31 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.31 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.466 ' O ' ' N ' ' A' ' 9' ' ' PHE . 30.0 t -102.37 146.68 10.03 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.71 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.6 ' HA ' HG13 ' A' ' 8' ' ' ILE . 88.0 p -85.96 146.71 26.56 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.595 -179.294 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.46 ' O ' ' N ' ' A' ' 7' ' ' ALA . . . -177.33 -179.1 47.47 Favored Glycine 0 N--CA 1.442 -0.907 0 CA-C-N 115.168 -0.924 . . . . 0.0 111.758 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.589 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.0 mm -104.48 137.57 32.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-O 120.951 0.405 . . . . 0.0 110.229 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.781 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.73 118.22 54.05 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 178.758 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.562 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -125.63 124.44 41.19 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.162 0.506 . . . . 0.0 111.484 -178.01 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.535 ' CG1' HD12 ' A' ' 27' ' ' LEU . 76.5 mt -98.72 139.24 21.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.04 -179.444 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -130.93 112.31 12.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.954 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -86.62 0.63 54.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.341 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -76.57 -17.79 59.02 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 121.029 0.442 . . . . 0.0 110.283 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -95.99 134.86 32.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.858 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.404 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 1.0 OUTLIER -111.37 116.68 50.59 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.016 -179.971 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.44 ' HG2' HG23 ' A' ' 41' ' ' VAL . 95.7 Cg_endo -78.21 154.05 92.9 Favored 'Cis proline' 0 C--N 1.349 0.554 0 C-N-CA 123.387 -1.505 . . . . 0.0 112.125 0.003 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.423 ' HB1' HD12 ' A' ' 42' ' ' LEU . . . -49.3 138.34 12.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.891 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -134.26 162.54 31.9 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.174 0.512 . . . . 0.0 111.517 -179.307 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.781 HD21 HG12 ' A' ' 16' ' ' ILE . 5.8 tt -121.25 125.39 46.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.536 179.244 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.2 m -113.24 126.95 55.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.156 0.503 . . . . 0.0 112.295 -178.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.47 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 64.2 t90 -100.41 128.97 46.33 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.914 178.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.673 ' HG3' HG22 ' A' ' 37' ' ' VAL . 15.9 ttm105 -128.31 117.94 22.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.824 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.444 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 17.0 t -44.73 155.88 0.09 Allowed 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.768 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.447 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -65.06 -39.62 93.53 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.529 0.681 . . . . 0.0 109.349 -179.925 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -79.99 -25.32 40.35 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 114.634 -1.166 . . . . 0.0 111.132 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 90.97 31.65 9.71 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.662 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -101.9 -21.2 14.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.61 0.243 . . . . 0.0 111.442 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 11.8 mtmt -128.69 138.33 52.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.764 0.316 . . . . 0.0 111.141 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.673 HG22 ' HG3' ' A' ' 30' ' ' ARG . 47.4 t -139.09 132.85 39.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.032 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.507 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 26.8 t-80 -136.65 146.31 45.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.137 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 49.0 m -127.68 139.1 52.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.107 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 96.1 t -128.49 140.91 47.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.183 0.516 . . . . 0.0 111.674 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.629 HG13 HG23 ' A' ' 44' ' ' THR . 2.0 p -87.64 118.17 32.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.386 -0.825 . . . . 0.0 109.22 178.215 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 1.097 HD13 HD13 ' A' ' 107' ' ' ILE . 89.2 mt -73.5 -30.72 63.31 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -178.67 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.409 ' HB2' ' HB2' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -53.14 -24.3 10.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.819 0.342 . . . . 0.0 111.69 -179.486 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.629 HG23 HG13 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -92.58 -24.67 18.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.103 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.768 HD12 ' HB3' ' A' ' 62' ' ' LEU . 39.2 mm -61.25 85.44 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.712 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -70.81 -29.04 65.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.543 -179.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.66 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 10.0 mmmt -139.35 146.44 40.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.024 0.44 . . . . 0.0 111.789 -179.234 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.645 HD23 ' HG2' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -126.74 126.36 43.34 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.741 179.138 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -119.87 149.45 42.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.971 0.415 . . . . 0.0 111.236 -179.243 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.701 ' HB3' ' NZ ' ' A' ' 101' ' ' LYS . . . -148.08 146.76 28.97 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.953 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 54.6 p -75.87 122.73 87.57 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.332 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -61.42 160.32 27.99 Favored 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 122.597 2.198 . . . . 0.0 112.578 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.453 ' HB2' ' NH2' ' A' ' 94' ' ' ARG . . . -59.68 -42.75 93.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.103 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 86.3 p -57.92 -26.94 62.87 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.044 0.45 . . . . 0.0 110.783 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.7 t -85.69 118.57 25.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.845 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -56.69 -18.5 12.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.542 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.428 ' HD2' ' CE3' ' B' ' 53' ' ' TRP . 69.3 mmtt -63.54 147.1 52.31 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.954 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.44 ' HE3' ' HB3' ' A' ' 58' ' ' MET . 19.6 mmm -133.74 85.0 2.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.592 -179.832 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.448 ' CE ' ' CE3' ' B' ' 53' ' ' TRP . 31.7 mtm -154.67 165.87 35.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.229 0.538 . . . . 0.0 112.002 -179.469 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.445 HD12 ' HB2' ' A' ' 50' ' ' ALA . 2.8 tp -133.79 126.81 31.4 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.997 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.1 ttt180 -117.1 127.18 53.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.928 0.394 . . . . 0.0 111.882 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.768 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -106.42 144.1 33.59 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.269 179.482 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.66 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 2.0 mm -111.27 126.04 68.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.818 0.342 . . . . 0.0 111.211 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -91.25 131.91 11.01 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.2 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -44.3 137.84 3.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.847 0.356 . . . . 0.0 111.245 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.757 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.4 p -93.85 -162.39 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.052 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.757 ' H ' HG22 ' A' ' 66' ' ' VAL . 52.1 t0 -167.38 73.28 0.12 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.088 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 85.6 mt-10 -55.11 -21.97 14.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.439 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 37.1 m -57.06 -19.01 16.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.174 179.69 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.78 -54.57 43.56 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.986 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.5 mmtt 60.92 93.64 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.838 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 10.8 mtt180 -111.22 143.83 41.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.835 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.1 mttp -98.48 145.21 27.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.168 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -87.65 175.25 7.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.899 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -64.31 -19.52 65.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.39 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 51.8 mp0 -86.95 6.39 32.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.59 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.47 14.59 82.33 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.766 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -104.65 148.96 25.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.767 0.317 . . . . 0.0 110.548 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -82.62 142.82 31.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.874 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.458 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.3 m -134.3 158.87 42.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.224 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 30.7 t -101.38 98.81 9.78 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.724 178.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.458 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 95.3 Cg_exo -42.99 145.4 1.17 Allowed 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.491 2.127 . . . . 0.0 112.681 -178.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.486 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 15.4 mttt -82.67 147.8 56.38 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.057 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 13.8 Cg_exo -74.18 160.69 42.09 Favored 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 123.394 2.729 . . . . 0.0 112.713 -179.121 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.53 151.31 46.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.668 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.81 120.99 7.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.096 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -99.48 158.47 15.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.419 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.2 ttt -133.62 132.46 40.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.026 0.441 . . . . 0.0 111.477 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.583 ' CD2' HD11 ' A' ' 16' ' ' ILE . 96.6 m-85 -138.93 146.25 40.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.367 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.426 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 6.1 t -121.96 133.76 54.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.948 0.404 . . . . 0.0 111.282 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.654 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 3.3 m-85 -123.47 171.26 9.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.718 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -130.89 20.49 4.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.171 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.442 ' ND2' HG23 ' A' ' 96' ' ' VAL . 45.1 t-20 -152.1 113.98 4.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.812 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.453 ' NH2' ' HB2' ' A' ' 53' ' ' ALA . 17.6 mmm180 -55.62 -31.74 62.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.914 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.03 -55.05 14.03 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.043 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.442 HG23 ' ND2' ' A' ' 93' ' ' ASN . 57.6 t -59.06 -47.68 89.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.338 179.449 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.436 ' HG3' ' CD1' ' A' ' 91' ' ' PHE . 16.4 ttp -64.46 -29.45 70.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.96 179.091 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -65.6 -34.08 77.41 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.403 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.428 ' O ' ' HB ' ' A' ' 103' ' ' THR . 22.3 m120 -69.15 -40.44 78.2 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.591 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.571 HD12 ' CG2' ' A' ' 16' ' ' ILE . 24.3 mm -65.56 -52.12 54.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.739 179.68 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.701 ' NZ ' ' HB3' ' A' ' 50' ' ' ALA . 1.0 OUTLIER -63.07 -28.28 69.98 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.85 179.794 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 40.7 mtm -78.78 -40.81 32.13 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.66 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.428 ' HB ' ' O ' ' A' ' 99' ' ' ASN . 0.6 OUTLIER -75.52 -36.71 60.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.896 -179.97 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.715 ' HA ' HD12 ' A' ' 107' ' ' ILE . 13.5 mt -62.24 -40.37 95.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.876 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.798 ' HA ' HD12 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -62.32 -27.66 69.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.949 179.77 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -69.39 -40.36 77.44 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.996 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.097 HD13 HD13 ' A' ' 42' ' ' LEU . 4.0 mt -65.58 -44.99 93.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.296 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.798 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.1 mt -59.7 -61.0 1.66 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.608 0 CA-C-O 121.692 0.758 . . . . 0.0 109.259 179.057 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.5 t -50.97 -28.96 10.99 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.301 -1.318 . . . . 0.0 110.906 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 53.5 mtt-85 -68.48 -33.75 74.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.06 0.457 . . . . 0.0 110.576 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -105.44 -1.2 25.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.892 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.401 ' N ' ' O ' ' A' ' 108' ' ' ILE . 0.7 OUTLIER -108.19 -32.86 7.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.821 -179.847 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 87.1 m-20 -63.34 -35.46 80.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.737 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.02 -33.79 75.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.135 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 48.0 t0 . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.912 -179.995 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 58.3 mt . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.81 0.338 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.3 m -128.11 163.64 42.51 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.944 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -57.67 -38.48 93.15 Favored 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 122.686 2.257 . . . . 0.0 112.275 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -51.58 -23.61 4.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.84 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -65.86 -44.71 84.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.684 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.434 ' HA ' ' CD1' ' B' ' 53' ' ' TRP . 33.4 mm -69.92 -22.82 24.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.338 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -62.69 -32.43 73.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.928 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.88 -30.26 67.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.189 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 53' ' ' TRP . . . . . 0.448 ' CE3' ' CE ' ' A' ' 59' ' ' MET . 24.2 m95 -54.59 -27.1 36.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.762 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 54' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -110.25 -18.94 13.17 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.151 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -85.64 -42.6 14.17 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.745 0.307 . . . . 0.0 110.78 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -60.0 141.86 54.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.858 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -127.3 76.02 76.75 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.909 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo . . . . . 0 C--O 1.249 1.036 0 C-N-CA 122.645 2.23 . . . . 0.0 112.262 -179.949 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo . . . . . 0 N--CA 1.476 0.476 0 CA-C-O 120.814 0.256 . . . . 0.0 111.834 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.6 p -88.36 126.8 35.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.899 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.459 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 50.5 m80 65.74 35.76 6.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.094 0.473 . . . . 0.0 111.373 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.49 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 68.5 p -178.35 152.05 0.65 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.908 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.404 ' CA ' ' CG1' ' A' ' 96' ' ' VAL . . . 176.17 116.53 0.46 Allowed Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.139 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.633 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -46.77 104.35 0.05 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.146 0.498 . . . . 0.0 111.386 -179.59 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.682 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -119.26 152.4 36.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.753 -178.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.645 HG23 ' O ' ' A' ' 12' ' ' VAL . 0.9 OUTLIER -100.63 125.76 54.4 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.267 0 CA-C-O 121.09 0.471 . . . . 0.0 110.469 179.0 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.506 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 4.3 t80 -113.3 130.78 56.17 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.125 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 81.8 mt-10 55.88 35.0 24.63 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.046 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 42.9 mtpt 75.78 1.49 3.55 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.362 -179.126 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.645 ' O ' HG23 ' A' ' 8' ' ' ILE . 41.0 t -99.8 155.46 4.14 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.616 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.554 ' HA ' HG13 ' A' ' 8' ' ' ILE . 71.9 p -98.44 148.58 23.57 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.572 0.701 . . . . 0.0 112.643 -178.642 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.482 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.86 -179.58 46.91 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 114.595 -1.184 . . . . 0.0 110.344 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.633 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.69 142.15 20.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 117.613 0.707 . . . . 0.0 110.465 179.344 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.855 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.68 118.45 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.766 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.561 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.426 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -119.3 137.79 53.45 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.234 -178.565 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.721 HD12 ' CG2' ' A' ' 103' ' ' THR . 64.8 mt -110.66 140.11 31.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.094 -179.101 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 -132.27 111.63 11.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.08 -179.636 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -91.14 3.44 54.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.2 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -78.81 -17.23 56.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.883 0.373 . . . . 0.0 110.469 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.87 141.66 16.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.941 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.469 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.3 t -114.37 116.58 43.94 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.747 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.469 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 1.6 Cg_endo -81.33 142.62 56.22 Favored 'Cis proline' 0 C--N 1.347 0.489 0 C-N-CA 123.818 -1.326 . . . . 0.0 111.904 -0.068 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.06 141.59 3.17 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.054 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -135.77 167.12 21.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.102 0.477 . . . . 0.0 111.739 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.855 HD21 HG12 ' A' ' 16' ' ' ILE . 4.5 tt -121.26 129.84 53.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.582 179.43 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.7 m -117.34 126.82 53.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.225 0.536 . . . . 0.0 112.156 -178.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.485 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 58.8 t90 -100.62 128.3 46.72 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.895 178.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.6 tpt180 -124.98 116.94 22.95 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.783 0.325 . . . . 0.0 111.065 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.482 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 12.5 m -45.49 166.23 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.01 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.75 -41.63 64.93 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.517 0.675 . . . . 0.0 109.526 179.558 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -84.66 -20.0 31.99 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.006 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.39 33.6 11.49 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.41 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -100.7 -22.85 14.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.658 0.266 . . . . 0.0 111.446 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 4.5 mtmt -130.23 137.56 50.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.777 0.322 . . . . 0.0 111.025 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 14.6 p -139.16 132.31 38.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.059 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.506 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 22.2 t-80 -131.38 145.94 52.05 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.045 0.45 . . . . 0.0 111.222 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 48.5 m -129.12 134.48 48.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.025 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.9 t -126.71 140.81 47.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.031 0.443 . . . . 0.0 111.447 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.633 HG22 HG23 ' A' ' 44' ' ' THR . 1.9 p -85.54 117.55 30.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.218 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 1.018 HD13 HD13 ' A' ' 107' ' ' ILE . 83.6 mt -75.39 -31.69 60.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.244 -0.434 . . . . 0.0 112.097 -178.552 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.446 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 10.9 t -53.95 -23.36 12.76 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -179.072 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.633 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -92.07 -21.24 20.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.716 0.293 . . . . 0.0 111.014 -179.736 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.86 HD12 ' HB3' ' A' ' 62' ' ' LEU . 36.4 mm -57.75 87.03 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.995 0.426 . . . . 0.0 111.067 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.416 ' N ' ' O ' ' A' ' 63' ' ' ILE . 21.8 t70 -64.77 -32.57 74.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.0 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.703 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 4.4 mmmt -142.67 149.7 39.22 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.055 0.455 . . . . 0.0 111.28 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.595 HD21 ' HG3' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -131.98 125.95 32.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.778 179.175 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -136.79 158.91 43.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.994 0.426 . . . . 0.0 111.431 -179.056 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 1.086 ' HB2' HD12 ' A' ' 60' ' ' LEU . . . -148.12 166.49 27.7 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.958 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.58 HG22 ' CD2' ' B' ' 54' ' ' PHE . 81.4 p -75.65 148.33 82.49 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.823 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.82 149.59 86.56 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.587 2.191 . . . . 0.0 112.362 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.82 -36.38 83.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.176 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.6 t -59.96 -26.29 65.88 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.994 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 24.1 t -86.62 117.09 25.16 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.918 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -56.98 -18.62 14.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.539 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.447 ' HD2' ' CE3' ' B' ' 53' ' ' TRP . 9.4 mttp -83.95 127.88 34.16 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.945 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.416 ' HB3' ' O ' ' A' ' 91' ' ' PHE . 2.0 ttm -102.02 149.88 23.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.935 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.451 ' HB3' HG23 ' A' ' 51' ' ' THR . 0.0 OUTLIER 178.38 138.91 0.09 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.914 0.388 . . . . 0.0 111.269 179.652 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 1.086 HD12 ' HB2' ' A' ' 50' ' ' ALA . 7.6 tp -126.1 123.92 39.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.122 179.463 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 20.8 mmt85 -110.14 123.56 49.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.929 0.395 . . . . 0.0 111.72 -179.298 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.86 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -109.25 128.07 54.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.372 179.466 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.703 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -105.63 122.69 59.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.576 -0.283 . . . . 0.0 110.986 179.871 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.89 -129.27 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.464 -0.874 . . . . 0.0 111.843 179.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.3 mttp -130.13 155.08 46.79 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.629 0.252 . . . . 0.0 110.516 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.75 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.2 p -118.78 -164.01 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.928 0.395 . . . . 0.0 111.243 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.75 ' H ' HG22 ' A' ' 66' ' ' VAL . 21.1 t70 -178.94 75.66 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.186 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.496 ' HG3' HG23 ' A' ' 81' ' ' VAL . 55.7 mp0 -55.0 -22.49 15.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.446 -179.412 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 37.6 m -58.24 -18.34 25.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.127 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.2 -61.4 1.83 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.907 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp 62.96 94.4 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.94 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.6 mtt180 -97.15 141.49 30.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.984 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.419 ' HA ' ' HA ' ' A' ' 79' ' ' GLU . 55.8 mmtt -78.76 145.13 34.57 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.911 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.499 ' HB3' HG11 ' A' ' 80' ' ' VAL . 37.3 p30 -97.23 175.85 6.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.068 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -60.59 -19.68 58.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.333 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -87.08 7.48 27.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.512 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.78 13.7 80.4 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.738 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -111.01 145.42 38.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.825 0.345 . . . . 0.0 110.845 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.419 ' HA ' ' HA ' ' A' ' 73' ' ' LYS . 96.9 mt-10 -72.16 143.13 49.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.069 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.499 HG11 ' HB3' ' A' ' 74' ' ' ASP . 1.3 m -140.59 151.82 20.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.072 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.496 HG23 ' HG3' ' A' ' 68' ' ' GLU . 2.3 p -85.62 108.62 17.1 Favored Pre-proline 0 C--N 1.319 -0.745 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.62 178.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.462 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 46.0 Cg_exo -56.72 145.98 79.64 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.125 1.883 . . . . 0.0 112.257 -178.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.413 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 18.6 mtmt -83.12 148.12 55.62 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.034 0.445 . . . . 0.0 110.882 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 13.2 Cg_exo -74.28 158.71 44.64 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 C-N-CA 123.342 2.695 . . . . 0.0 112.695 -179.032 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.47 136.31 56.28 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.61 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 32.2 mtm105 -134.69 138.31 44.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.852 0.358 . . . . 0.0 111.214 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -118.15 157.03 27.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.358 179.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.809 ' SD ' HG21 ' B' ' 50' ' ' ILE . 8.5 ttt -133.58 120.48 20.79 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.95 0.405 . . . . 0.0 111.372 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.642 ' CE2' HD11 ' A' ' 16' ' ' ILE . 97.0 m-85 -126.24 133.05 51.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.574 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -106.09 133.63 50.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.885 0.374 . . . . 0.0 111.147 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.682 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 2.5 m-85 -122.74 170.45 10.05 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.575 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -121.57 -22.83 5.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.801 0.334 . . . . 0.0 111.304 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -108.1 100.2 9.56 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.38 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -47.8 -30.16 3.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.111 0.481 . . . . 0.0 111.111 -179.713 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.45 -47.58 54.82 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.227 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.404 ' CG1' ' CA ' ' A' ' 5' ' ' GLY . 57.5 t -61.31 -50.22 81.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.395 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.829 ' HE3' ' HB1' ' A' ' 50' ' ' ALA . 41.8 ttp -62.49 -29.61 70.67 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -60.31 -34.49 73.86 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 121.098 0.475 . . . . 0.0 109.953 179.137 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 22.4 m120 -71.56 -33.68 69.31 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.891 178.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.508 HG21 HD22 ' A' ' 60' ' ' LEU . 19.6 mm -61.8 -47.83 91.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.586 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.651 ' HD3' ' HB3' ' A' ' 50' ' ' ALA . 13.4 mttt -67.47 -27.97 67.47 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.21 0.528 . . . . 0.0 110.357 179.354 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 77.5 mtp -78.55 -39.41 37.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.505 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.721 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -76.43 -40.54 50.39 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.714 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.743 ' HA ' HD12 ' A' ' 107' ' ' ILE . 18.9 mt -63.78 -36.83 85.19 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.85 0.357 . . . . 0.0 110.516 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.757 ' HA ' HD12 ' A' ' 108' ' ' ILE . 20.7 mt-30 -63.3 -29.37 70.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.973 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -68.98 -31.5 70.39 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.141 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.018 HD13 HD13 ' A' ' 42' ' ' LEU . 4.2 mt -76.49 -46.15 32.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.479 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.945 HG22 ' CD ' ' A' ' 112' ' ' LYS . 2.2 mt -57.1 -61.38 1.28 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.568 0 CA-C-O 121.746 0.784 . . . . 0.0 109.544 179.326 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 18.2 t -50.27 -28.84 8.4 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.396 -1.275 . . . . 0.0 110.462 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.36 -35.01 79.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.671 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -89.55 -31.28 17.69 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.869 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.945 ' CD ' HG22 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -65.36 -41.17 94.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.956 0.408 . . . . 0.0 110.603 179.625 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -59.78 -37.35 78.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.926 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.94 -32.77 74.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.094 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.915 -179.99 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 40.0 mt . . . . . 0 N--CA 1.488 1.436 0 CA-C-O 120.879 0.371 . . . . 0.0 111.133 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.7 m -122.46 160.75 46.94 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.872 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_exo -52.25 -40.75 69.06 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.586 2.191 . . . . 0.0 112.347 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -56.65 -27.32 58.28 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.038 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -64.34 -43.12 95.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.852 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.809 HG21 ' SD ' ' A' ' 88' ' ' MET . 37.9 mm -69.9 -27.15 31.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.195 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.72 -33.22 75.45 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.876 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.68 -28.91 69.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.052 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 53' ' ' TRP . . . . . 0.447 ' CE3' ' HD2' ' A' ' 57' ' ' LYS . 11.9 m0 -55.21 -31.18 61.24 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.898 0.38 . . . . 0.0 110.913 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 54' ' ' PHE . . . . . 0.58 ' CD2' HG22 ' A' ' 51' ' ' THR . 71.5 m-85 -77.1 -34.97 56.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.02 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -82.21 -51.92 7.46 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.86 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -80.12 143.11 34.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.926 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -130.49 160.88 63.89 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.884 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo . . . . . 0 C--O 1.25 1.117 0 C-N-CA 122.594 2.196 . . . . 0.0 112.307 -179.978 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo . . . . . 0 N--CA 1.476 0.479 0 CA-C-O 120.808 0.253 . . . . 0.0 111.827 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.9 t 58.06 99.76 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.019 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 79.4 m80 64.16 33.44 11.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.234 0.54 . . . . 0.0 110.981 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.615 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 53.0 p 179.33 174.62 0.75 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.62 179.086 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.409 ' HA3' HG13 ' A' ' 96' ' ' VAL . . . 153.53 120.03 0.77 Allowed Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.466 -0.874 . . . . 0.0 112.522 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.628 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -47.21 105.76 0.07 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.151 0.501 . . . . 0.0 111.34 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.759 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -120.49 151.52 39.25 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.761 -178.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.567 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -99.67 124.26 52.94 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.256 0 CA-C-O 121.014 0.435 . . . . 0.0 110.29 179.046 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.489 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 16.9 t80 -112.7 130.38 56.08 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.112 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.42 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 83.4 mt-10 56.4 34.21 23.79 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.037 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.0 mttm 76.24 1.35 3.39 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.249 -179.121 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.529 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.6 t -99.71 154.42 4.26 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.671 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 178.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.567 ' HA ' HG13 ' A' ' 8' ' ' ILE . 78.0 p -97.31 148.47 23.1 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-O 121.604 0.716 . . . . 0.0 112.546 -178.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.462 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.59 -179.72 46.61 Favored Glycine 0 N--CA 1.447 -0.627 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.397 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.628 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.66 142.2 20.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 117.74 0.77 . . . . 0.0 110.521 179.369 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.706 HD11 ' CE2' ' A' ' 89' ' ' PHE . 0.1 OUTLIER -106.69 118.56 54.64 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.758 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 179.557 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.499 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -121.3 134.46 55.15 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.315 -178.658 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.533 HD12 ' CG2' ' A' ' 103' ' ' THR . 96.7 mt -111.04 140.09 31.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.194 -179.158 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -128.72 112.65 14.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.004 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -87.36 6.16 34.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.267 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -78.34 -18.31 55.34 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.912 0.387 . . . . 0.0 110.411 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -100.39 146.76 8.57 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.859 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.401 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.5 t -121.51 115.5 31.07 Favored Pre-proline 0 CA--C 1.532 0.269 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.957 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.433 ' HB3' ' CB ' ' A' ' 43' ' ' SER . 5.6 Cg_exo -77.67 145.28 79.06 Favored 'Cis proline' 0 C--N 1.348 0.501 0 C-N-CA 123.633 -1.403 . . . . 0.0 111.842 -0.078 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.678 ' O ' HD22 ' A' ' 42' ' ' LEU . . . -44.15 140.81 1.98 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.818 0.342 . . . . 0.0 110.916 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -124.69 157.72 34.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.132 0.491 . . . . 0.0 111.716 -179.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.694 ' HB2' HD11 ' A' ' 42' ' ' LEU . 4.4 tt -121.28 128.9 52.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.494 179.401 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.9 m -119.63 125.79 49.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.143 0.496 . . . . 0.0 112.168 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.489 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 60.2 t90 -100.49 127.79 46.74 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.727 178.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 44.8 ttp85 -122.0 117.15 25.68 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.798 0.333 . . . . 0.0 111.013 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.462 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 64.0 m -46.66 162.93 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.913 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.83 -41.57 68.0 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.536 0.684 . . . . 0.0 109.551 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -82.14 -21.14 36.78 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.803 -1.09 . . . . 0.0 111.044 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.09 34.48 12.64 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.329 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 51.9 t0 -104.0 -19.4 14.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.615 0.245 . . . . 0.0 111.614 -179.678 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.57 142.17 45.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.888 0.375 . . . . 0.0 111.327 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 48.6 t -139.26 138.05 40.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.925 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.489 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 16.6 t-80 -134.55 145.77 49.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.207 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.449 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 43.5 m -129.31 134.86 48.12 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.175 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 90.8 t -135.04 139.69 46.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 CA-C-O 121.127 0.489 . . . . 0.0 111.836 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.565 HG22 HG23 ' A' ' 44' ' ' THR . 1.6 p -88.63 117.46 32.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.505 177.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.766 ' H ' HD22 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -73.95 -28.28 61.43 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -179.035 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.433 ' CB ' ' HB3' ' A' ' 24' ' ' PRO . 11.9 t -55.96 -21.59 21.77 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.157 0.429 . . . . 0.0 112.157 -179.161 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.565 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -96.54 -21.9 17.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.833 0.349 . . . . 0.0 111.413 -179.446 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.918 HD12 ' HB3' ' A' ' 62' ' ' LEU . 47.6 mm -53.18 94.19 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.028 0.442 . . . . 0.0 111.053 -179.751 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -61.15 -28.87 69.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.393 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.615 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 16.3 mttm -153.41 162.92 40.78 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.167 0.508 . . . . 0.0 111.603 -179.711 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.796 HD11 ' HB3' ' A' ' 104' ' ' LEU . 22.2 mt -123.88 124.36 42.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.362 179.309 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.441 ' NE2' ' CG ' ' B' ' 54' ' ' PHE . 63.5 tt0 -111.07 130.34 55.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.621 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.585 ' HB3' ' NZ ' ' A' ' 101' ' ' LYS . . . -145.81 138.84 25.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.218 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.547 HG21 ' HB3' ' A' ' 57' ' ' LYS . 57.2 p -75.75 122.05 86.29 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.496 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -62.6 160.54 31.83 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.563 2.175 . . . . 0.0 112.49 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.92 -43.14 91.06 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.131 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.2 m -60.85 -27.71 68.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.06 0.457 . . . . 0.0 110.63 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 26.3 t -79.48 122.03 25.93 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.97 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -56.61 -18.74 13.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.284 179.149 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.547 ' HB3' HG21 ' A' ' 51' ' ' THR . 12.1 mptt -65.46 151.83 45.4 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.72 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.514 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 48.5 mtp -143.0 79.82 1.66 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.98 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.475 ' HG2' ' HE1' ' A' ' 88' ' ' MET . 0.9 OUTLIER -155.71 169.02 25.32 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.016 0.436 . . . . 0.0 111.569 -179.783 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.682 HD23 HD11 ' A' ' 62' ' ' LEU . 0.4 OUTLIER -135.85 126.82 27.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.147 179.554 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.442 ' HD3' ' CE1' ' B' ' 54' ' ' PHE . 32.8 mtp180 -119.06 129.9 55.34 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.93 0.395 . . . . 0.0 111.657 -179.342 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.918 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -106.1 141.81 36.85 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.397 179.613 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.615 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.1 mm -105.15 112.84 40.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.687 0.279 . . . . 0.0 111.326 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -83.82 125.36 7.03 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.605 -0.807 . . . . 0.0 112.36 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 50.6 mttt -49.46 153.6 1.07 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.826 0.346 . . . . 0.0 111.185 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.718 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.3 p -117.65 -161.9 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.061 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.718 ' H ' HG22 ' A' ' 66' ' ' VAL . 23.5 m-20 -167.37 62.21 0.08 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.496 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -49.58 -28.27 5.47 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.402 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 36.9 m -54.44 -18.83 4.66 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.118 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.7 mmtp -62.44 -37.3 85.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.858 0.361 . . . . 0.0 110.988 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.6 mptt 61.37 93.48 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.864 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 -104.72 157.3 17.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.861 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -111.27 145.5 38.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.896 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.405 ' HB3' HG11 ' A' ' 80' ' ' VAL . 35.7 p30 -93.07 174.45 7.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.987 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -62.14 -18.36 60.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.393 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -86.95 7.98 25.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.556 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.93 11.25 81.23 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.718 -0.754 . . . . 0.0 112.694 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -106.55 146.09 31.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.844 0.354 . . . . 0.0 110.709 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -73.77 148.83 42.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.971 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.477 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.4 m -136.11 159.05 38.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.982 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.9 t -100.54 98.74 8.54 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.701 178.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.477 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 79.8 Cg_exo -44.17 145.13 2.42 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.402 2.068 . . . . 0.0 112.789 -179.085 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.439 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 8.6 mtmt -95.11 151.05 38.53 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.879 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 18.0 Cg_exo -71.4 143.43 43.14 Favored 'Trans proline' 0 N--CA 1.465 -0.198 0 C-N-CA 123.48 2.786 . . . . 0.0 112.746 -178.949 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.1 mm-40 -65.37 151.47 46.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.02 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 90.5 mtt180 -148.79 119.78 7.68 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.565 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -98.71 150.88 21.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.759 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.475 ' HE1' ' HG2' ' A' ' 59' ' ' MET . 1.3 tmt? -128.47 122.23 30.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.13 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.706 ' CE2' HD11 ' A' ' 16' ' ' ILE . 93.2 m-85 -127.2 155.1 43.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.604 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 35.7 t -129.35 134.96 48.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.906 0.384 . . . . 0.0 110.953 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.759 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 3.0 m-85 -127.48 147.99 50.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.685 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.514 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 47.6 m-20 -95.33 -24.03 16.92 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.242 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.493 ' HB2' HG23 ' A' ' 96' ' ' VAL . 92.6 m-20 -106.59 115.53 30.35 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.806 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -57.29 -31.28 65.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.936 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.02 -45.06 90.58 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.233 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.493 HG23 ' HB2' ' A' ' 93' ' ' ASN . 57.4 t -58.24 -44.19 87.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.754 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.438 ' HG2' ' CG ' ' A' ' 91' ' ' PHE . 3.2 mtm -60.72 -32.24 71.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.316 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.517 ' O ' ' HE2' ' A' ' 102' ' ' MET . 48.8 t0 -64.06 -29.98 71.09 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.881 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 21.6 m120 -80.89 -50.17 10.1 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.02 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.527 HD12 ' CG2' ' A' ' 16' ' ' ILE . 23.5 mm -58.68 -52.26 62.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.005 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.585 ' NZ ' ' HB3' ' A' ' 50' ' ' ALA . 2.2 ttmt -61.16 -32.08 71.81 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.952 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.517 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 33.4 mtm -78.86 -40.36 32.76 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.166 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.533 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -72.16 -41.32 67.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.275 -179.552 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.796 ' HB3' HD11 ' A' ' 48' ' ' LEU . 12.5 mt -64.05 -38.42 91.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.789 0.328 . . . . 0.0 110.775 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.772 ' HA ' HD12 ' A' ' 108' ' ' ILE . 2.2 mt-30 -65.61 -28.81 69.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.764 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -68.52 -35.94 78.16 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.673 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.746 HD13 HD23 ' A' ' 42' ' ' LEU . 57.8 mt -68.35 -46.7 80.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.081 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.772 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.2 mt -59.02 -61.12 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.508 -0.637 0 CA-C-O 121.809 0.814 . . . . 0.0 109.218 179.099 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 8.5 t -50.53 -28.72 9.07 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.379 -1.282 . . . . 0.0 110.434 179.1 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.45 -48.94 68.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.412 0.625 . . . . 0.0 109.841 179.336 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.403 ' CE2' ' CB ' ' A' ' 43' ' ' SER . 39.4 m-85 -75.36 -28.99 59.77 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.291 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.48 ' HE2' HG22 ' A' ' 108' ' ' ILE . 11.4 mttm -63.83 -47.95 78.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.662 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -62.78 -38.82 92.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.942 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.9 -34.94 79.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.127 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.16 -0.924 . . . . 0.0 110.899 179.959 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 49.7 mt . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.813 0.34 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 9.8 t -129.6 151.49 78.11 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.941 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -52.63 -30.27 44.84 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.479 2.119 . . . . 0.0 112.359 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -55.5 -22.95 23.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.115 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -81.61 -38.38 26.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.262 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 34.6 mm -78.39 -28.34 14.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.759 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -69.44 -30.64 68.61 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.917 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.09 -28.92 67.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.903 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 53' ' ' TRP . . . . . 0.42 ' CE3' ' HG3' ' A' ' 57' ' ' LYS . 10.2 m0 -54.1 -36.4 63.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.959 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 54' ' ' PHE . . . . . 0.442 ' CE1' ' HD3' ' A' ' 61' ' ' ARG . 91.2 m-85 -83.82 -26.96 29.12 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.992 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.38 -34.63 61.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.765 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 44.68 -166.17 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.408 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -122.05 160.94 45.21 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.862 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo . . . . . 0 C--O 1.249 1.042 0 C-N-CA 122.568 2.179 . . . . 0.0 112.325 179.964 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo . . . . . 0 N--CA 1.475 0.436 0 CA-C-O 120.882 0.284 . . . . 0.0 111.708 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.1 m -165.93 -76.93 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.892 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.419 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 54.8 m80 -113.05 34.0 4.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.164 0.507 . . . . 0.0 111.046 -179.722 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.493 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 36.5 p -170.48 145.42 2.61 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.547 179.137 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -177.69 116.91 0.56 Allowed Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.375 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.63 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -45.65 105.15 0.06 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.094 0.473 . . . . 0.0 111.437 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.761 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -120.59 151.42 39.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.905 -178.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.555 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -100.3 124.55 53.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.998 0.428 . . . . 0.0 110.425 179.145 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.501 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 11.1 t80 -112.79 130.58 56.03 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.179 179.881 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 56.14 34.24 23.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.007 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 25.8 mttp 76.38 1.06 3.32 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.334 -179.061 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.541 ' O ' HG23 ' A' ' 8' ' ' ILE . 41.7 t -99.35 154.93 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.633 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 178.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.555 ' HA ' HG13 ' A' ' 8' ' ' ILE . 98.1 p -98.05 148.72 23.23 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-O 121.67 0.748 . . . . 0.0 112.794 -178.647 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.453 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 175.52 -179.79 46.51 Favored Glycine 0 N--CA 1.446 -0.672 0 CA-C-N 114.452 -1.249 . . . . 0.0 110.285 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.63 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.61 143.13 17.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 117.688 0.744 . . . . 0.0 110.403 179.372 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.827 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.58 118.26 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 CA-C-N 115.335 -0.848 . . . . 0.0 108.767 179.575 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -121.52 124.58 44.75 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.2 0.524 . . . . 0.0 111.389 -178.545 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.736 HG23 HD11 ' A' ' 42' ' ' LEU . 53.6 mt -94.52 140.03 17.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.903 -179.54 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -127.37 111.53 13.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.079 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -95.81 5.39 51.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.239 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -79.71 -17.4 53.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.962 0.41 . . . . 0.0 110.538 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -102.96 145.39 12.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.938 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.404 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 4.4 t -119.67 116.41 33.24 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.86 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.413 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 73.0 Cg_endo -77.81 144.44 76.5 Favored 'Cis proline' 0 C--N 1.348 0.552 0 C-N-CA 123.491 -1.462 . . . . 0.0 112.332 0.09 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.411 ' HB1' HD12 ' A' ' 42' ' ' LEU . . . -50.7 151.4 2.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.88 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -137.62 165.75 25.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.201 0.524 . . . . 0.0 111.838 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.827 HD21 HG12 ' A' ' 16' ' ' ILE . 5.8 tt -121.24 121.98 38.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.325 179.426 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 41.0 m -112.56 124.93 53.64 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.482 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 56.3 t90 -100.65 127.74 46.95 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.875 178.809 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.17 118.33 27.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.852 0.358 . . . . 0.0 111.195 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.424 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 25.5 t -46.04 167.76 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.047 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.46 -42.43 59.07 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.481 0.658 . . . . 0.0 109.677 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 89.7 m-20 -89.11 -17.02 30.1 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.771 -1.104 . . . . 0.0 111.109 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.94 33.35 11.09 Favored Glycine 0 C--N 1.332 0.359 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.362 -179.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -95.46 -22.15 17.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.594 0.235 . . . . 0.0 111.492 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.6 143.08 37.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.826 0.346 . . . . 0.0 111.365 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 14.5 p -139.24 137.62 41.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.893 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.501 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 6.1 t-80 -131.28 145.64 51.97 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.97 0.414 . . . . 0.0 111.218 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 40.9 m -129.09 136.03 49.69 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.959 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.694 ' CG1' HD11 ' A' ' 45' ' ' ILE . 77.5 t -130.07 141.73 45.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.235 0.54 . . . . 0.0 111.788 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.713 ' HB ' HG23 ' A' ' 44' ' ' THR . 0.0 OUTLIER -85.31 118.11 31.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.649 178.029 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 1.001 HD13 HD13 ' A' ' 107' ' ' ILE . 27.6 mt -66.89 -19.55 65.75 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.804 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.413 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 6.5 t -67.76 -25.43 65.62 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.799 179.54 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.713 HG23 ' HB ' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -87.1 -37.68 17.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.825 179.864 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.857 HG23 ' HB2' ' A' ' 62' ' ' LEU . 8.9 mm -58.31 87.99 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.492 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -83.96 -25.53 29.97 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.77 -178.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.559 ' HB2' HG12 ' A' ' 63' ' ' ILE . 13.6 mttp -125.17 158.0 35.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.21 0.529 . . . . 0.0 111.902 -179.098 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.854 HD12 ' HG3' ' A' ' 105' ' ' GLN . 28.8 mt -131.44 128.84 40.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.556 179.168 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.428 ' HG2' ' CD2' ' B' ' 54' ' ' PHE . 35.8 tt0 -129.54 130.38 45.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.885 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.458 ' HB2' ' CD1' ' A' ' 60' ' ' LEU . . . -143.51 137.66 28.65 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.019 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.469 ' O ' ' HE1' ' A' ' 97' ' ' MET . 31.6 p -75.67 126.24 87.53 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.8 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.43 160.74 46.44 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.509 2.139 . . . . 0.0 112.449 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.801 ' HB2' ' NH1' ' A' ' 94' ' ' ARG . . . -56.96 -42.95 81.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.11 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.0 m -61.5 -27.64 68.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.052 0.453 . . . . 0.0 110.697 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.3 m -77.48 121.68 24.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.879 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -56.22 -18.82 11.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.322 179.122 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.54 140.88 42.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.774 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 33.3 mtp -130.89 79.92 1.92 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.737 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.466 ' HE3' ' CE3' ' B' ' 53' ' ' TRP . 0.7 OUTLIER -150.83 168.75 23.49 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.135 0.493 . . . . 0.0 111.579 -179.683 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.458 ' CD1' ' HB2' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -137.84 123.78 20.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.973 179.474 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.419 ' O ' ' N ' ' A' ' 49' ' ' GLN . 40.4 ttt180 -127.93 136.78 51.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.795 0.331 . . . . 0.0 111.689 -179.238 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.857 ' HB2' HG23 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -119.41 144.09 47.12 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.443 179.227 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.688 ' N ' HD13 ' A' ' 63' ' ' ILE . 1.1 mm -101.08 134.23 41.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.827 0.346 . . . . 0.0 110.986 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -82.73 153.22 31.13 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.186 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.432 ' N ' ' O ' ' A' ' 44' ' ' THR . 38.4 mttt -60.12 163.13 5.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.709 0.29 . . . . 0.0 110.735 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.79 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.4 p -116.9 -163.43 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 121.018 0.437 . . . . 0.0 111.279 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.79 ' H ' HG22 ' A' ' 66' ' ' VAL . 56.0 m-20 -160.59 71.14 0.43 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.092 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.421 ' HG2' HG13 ' A' ' 81' ' ' VAL . 96.6 mt-10 -55.51 -20.9 14.36 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.534 -179.251 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 31.0 m -53.71 -21.69 7.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.797 0.332 . . . . 0.0 111.124 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.8 mtmm -76.32 -48.71 19.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.965 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 60.66 92.83 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.949 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 10.9 mtm180 -94.48 129.25 41.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.824 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 79' ' ' GLU . 29.1 mmtp -81.21 145.3 31.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.045 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -92.65 179.83 5.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.955 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -64.93 -18.84 65.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.333 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -87.82 -2.84 58.87 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.274 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.69 8.23 73.77 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.699 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 22.7 p30 -105.58 145.99 30.24 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.883 0.373 . . . . 0.0 110.93 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.421 ' HA ' ' HA ' ' A' ' 73' ' ' LYS . 49.5 mt-10 -71.83 143.78 49.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.92 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.444 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.8 m -138.86 158.77 30.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.165 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.421 HG13 ' HG2' ' A' ' 68' ' ' GLU . 37.4 t -83.88 110.22 24.01 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.434 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.444 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 88.3 Cg_exo -46.8 169.67 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.217 1.944 . . . . 0.0 112.758 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.498 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.1 OUTLIER -90.4 95.88 0.81 Allowed Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.215 -179.873 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.498 ' HD2' ' HA ' ' A' ' 83' ' ' LYS . 7.9 Cg_endo -46.53 161.45 0.18 Allowed 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 123.41 2.74 . . . . 0.0 112.363 179.289 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -65.48 159.92 23.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.655 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.641 ' HG2' HD12 ' A' ' 63' ' ' ILE . 6.2 mtp180 -155.23 133.15 11.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.24 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -118.52 133.3 55.98 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.314 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 22.7 ttt -113.95 137.29 51.88 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.986 0.422 . . . . 0.0 111.47 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.478 ' CE1' HD11 ' A' ' 16' ' ' ILE . 99.0 m-85 -139.27 151.22 46.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.486 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -123.27 135.24 54.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.893 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.761 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 2.8 m-85 -128.42 160.31 32.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.951 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 68.4 m-20 -110.64 9.96 22.89 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.277 179.499 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -141.64 107.75 5.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.636 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.801 ' NH1' ' HB2' ' A' ' 53' ' ' ALA . 1.9 tmm_? -49.02 -30.28 5.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.272 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.56 -55.11 6.73 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.451 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 56.4 t -55.39 -48.17 77.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.873 0.368 . . . . 0.0 110.707 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.469 ' HE1' ' O ' ' A' ' 51' ' ' THR . 15.4 ptm -63.82 -38.03 89.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.917 179.148 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -61.47 -34.36 75.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.365 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.431 ' O ' ' HB ' ' A' ' 103' ' ' THR . 81.6 m-20 -66.92 -41.45 87.06 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.631 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.594 HD12 ' CG2' ' A' ' 16' ' ' ILE . 27.2 mm -60.69 -52.37 62.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.853 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.633 ' O ' HD13 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -67.16 -27.87 67.65 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.254 179.534 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 39.7 mtm -78.11 -36.89 47.43 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.72 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.448 HG22 HD13 ' A' ' 18' ' ' ILE . 0.5 OUTLIER -79.47 -39.85 31.21 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.497 179.815 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.704 ' CD2' HD22 ' A' ' 42' ' ' LEU . 28.1 mt -59.99 -35.69 75.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.764 179.729 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.854 ' HG3' HD12 ' A' ' 48' ' ' LEU . 1.9 mt-30 -61.39 -32.18 72.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.796 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -65.64 -28.17 68.91 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.076 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.001 HD13 HD13 ' A' ' 42' ' ' LEU . 3.1 mt -81.11 -44.14 20.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.634 -179.58 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.659 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.2 mt -58.19 -61.35 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.585 0 CA-C-O 121.603 0.716 . . . . 0.0 109.444 179.402 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.7 p -49.08 -31.14 7.37 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.48 -1.236 . . . . 0.0 110.366 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -61.78 -41.8 98.18 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.568 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -85.3 -29.07 24.85 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.428 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.425 ' HE2' HG22 ' A' ' 108' ' ' ILE . 11.6 mttm -62.11 -42.0 98.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.524 179.424 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -53.96 -37.14 63.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.061 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.02 -33.61 75.8 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.062 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 52.1 t0 . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.276 -0.868 . . . . 0.0 110.922 -179.961 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 60.6 mt . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.92 0.39 . . . . 0.0 111.219 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.3 m -128.98 163.81 43.15 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.793 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -53.94 -41.85 71.59 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.588 2.192 . . . . 0.0 112.289 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -55.79 -22.53 24.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.816 179.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -66.83 -49.43 65.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.759 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 41.4 mm -65.11 -24.72 35.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.175 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -63.69 -33.23 75.17 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.813 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -69.18 -31.04 69.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.966 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 53' ' ' TRP . . . . . 0.466 ' CE3' ' HE3' ' A' ' 59' ' ' MET . 15.0 m95 -54.99 -24.85 26.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.728 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 54' ' ' PHE . . . . . 0.449 ' CE2' ' CG2' ' A' ' 51' ' ' THR . 13.0 m-85 -115.39 -11.42 11.87 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.314 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -93.76 -29.75 15.21 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.712 0.291 . . . . 0.0 111.0 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -60.78 -37.71 82.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.949 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 10.4 t70 55.49 83.99 0.22 Allowed Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.147 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_exo . . . . . 0 C--O 1.25 1.093 0 C-N-CA 122.529 2.153 . . . . 0.0 112.431 179.936 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo . . . . . 0 N--CA 1.475 0.432 0 CA-C-O 120.745 0.227 . . . . 0.0 111.89 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 57.22 106.52 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.08 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 75.6 m80 63.93 31.9 13.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.195 0.521 . . . . 0.0 111.042 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.631 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 88.4 p 178.15 172.7 0.66 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.744 178.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.407 ' CA ' ' CG1' ' A' ' 96' ' ' VAL . . . 154.64 116.32 0.57 Allowed Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.746 -0.74 . . . . 0.0 111.966 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.583 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -40.39 117.56 0.82 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.846 0.355 . . . . 0.0 111.144 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.669 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -132.67 149.7 52.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.844 -178.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.596 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.1 mp -97.46 124.2 50.25 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 CA-C-O 121.023 0.44 . . . . 0.0 110.528 179.282 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.506 ' CD1' ' CE2' ' A' ' 89' ' ' PHE . 10.1 t80 -115.8 129.4 56.42 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.927 179.658 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 58.71 33.91 23.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.794 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.0 mttp 75.63 1.64 3.62 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.142 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.542 HG21 ' NZ ' ' A' ' 36' ' ' LYS . 32.7 t -100.94 151.42 5.34 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.694 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.596 ' HA ' HG13 ' A' ' 8' ' ' ILE . 85.3 p -90.36 145.89 24.6 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 121.435 0.636 . . . . 0.0 111.678 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.438 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -176.64 -179.22 46.96 Favored Glycine 0 N--CA 1.444 -0.817 0 CA-C-N 114.979 -1.009 . . . . 0.0 111.691 -179.693 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.583 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.9 mm -105.61 137.52 35.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 121.034 0.445 . . . . 0.0 110.194 179.667 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.753 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.1 OUTLIER -106.54 117.92 53.24 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.672 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.564 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -124.4 131.07 53.5 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.366 -177.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.766 HG23 HD11 ' A' ' 42' ' ' LEU . 89.0 mt -106.45 140.04 25.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.27 -179.261 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -132.25 112.49 12.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.971 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -90.95 6.14 45.85 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.215 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -79.44 -17.53 54.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.872 0.368 . . . . 0.0 110.529 179.324 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -100.2 143.27 14.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.972 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.445 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.9 t -115.15 116.26 42.36 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.821 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.445 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 1.8 Cg_endo -80.52 143.64 64.55 Favored 'Cis proline' 0 C--N 1.349 0.576 0 C-N-CA 123.701 -1.374 . . . . 0.0 111.928 -0.02 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.21 141.3 4.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.732 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 68.4 mt-10 -134.5 166.24 23.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.172 0.51 . . . . 0.0 111.877 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.677 HD21 HG12 ' A' ' 16' ' ' ILE . 5.5 tt -121.33 127.58 51.43 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.555 179.32 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 41.0 m -116.6 129.61 56.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.212 0.53 . . . . 0.0 112.13 -178.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.496 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 56.3 t90 -100.47 125.69 46.81 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.984 178.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -122.61 117.3 25.52 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.71 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.412 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 30.3 t -44.48 158.96 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.752 0.311 . . . . 0.0 110.88 -179.708 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.438 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -66.42 -39.48 88.97 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 121.616 0.722 . . . . 0.0 109.352 179.9 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 42.8 p30 -89.46 -18.93 25.78 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.296 179.834 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.04 32.0 11.3 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.672 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -99.29 -18.88 17.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.725 0.297 . . . . 0.0 111.467 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.542 ' NZ ' HG21 ' A' ' 12' ' ' VAL . 8.8 mtmt -134.97 140.6 45.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.089 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.2 t -139.11 137.09 42.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.897 0.38 . . . . 0.0 111.294 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.506 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 82.5 t60 -137.7 146.3 43.6 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.088 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 47.8 m -129.07 138.0 51.6 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.216 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.5 t -132.15 140.87 46.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 121.095 0.474 . . . . 0.0 111.421 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.574 HG22 HG23 ' A' ' 44' ' ' THR . 2.3 p -86.02 117.84 31.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.051 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 1.055 HD13 HD13 ' A' ' 107' ' ' ILE . 78.7 mt -75.47 -31.2 60.17 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.095 0.405 . . . . 0.0 112.095 -178.539 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.421 ' HB3' ' HB3' ' A' ' 24' ' ' PRO . 58.3 p -55.63 -21.86 19.81 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.122 0.415 . . . . 0.0 112.122 -178.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.574 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -96.28 -21.84 17.59 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.756 0.312 . . . . 0.0 111.271 -179.785 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.606 HD12 ' HB3' ' A' ' 62' ' ' LEU . 38.0 mm -50.19 95.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.059 0.457 . . . . 0.0 111.039 -179.755 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -67.68 -27.94 67.26 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.317 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.602 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 38.4 mttm -156.72 159.89 38.79 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.045 0.45 . . . . 0.0 111.569 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.578 HD23 ' HG3' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -131.73 128.16 38.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.777 179.357 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.787 ' O ' HD23 ' A' ' 60' ' ' LEU . 93.0 mt-30 -119.59 141.02 49.65 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.937 0.399 . . . . 0.0 111.071 -179.363 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.85 143.25 31.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.992 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.693 HG23 ' O ' ' A' ' 59' ' ' MET . 43.0 p -75.7 111.21 13.33 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.597 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -64.56 160.59 39.09 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.559 2.173 . . . . 0.0 112.621 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.21 -41.84 72.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.186 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.0 m -58.12 -27.54 63.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.115 0.484 . . . . 0.0 110.788 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 31.4 t -86.29 118.65 25.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.817 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -57.18 -18.36 15.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.476 179.321 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.403 ' HD2' ' CD2' ' B' ' 53' ' ' TRP . 71.4 mmtt -72.95 145.64 46.62 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.061 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 59.1 mtp -129.9 95.13 3.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.583 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.693 ' O ' HG23 ' A' ' 51' ' ' THR . 3.1 tmm? -175.36 148.65 0.96 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.053 0.454 . . . . 0.0 111.266 -179.411 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.787 HD23 ' O ' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -114.32 145.7 41.45 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.368 179.694 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.426 ' HB2' ' CZ ' ' B' ' 54' ' ' PHE . 16.1 mtt-85 -130.88 131.68 44.68 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.004 0.43 . . . . 0.0 111.726 -179.704 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.606 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -111.48 142.06 44.25 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.361 179.41 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.602 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.6 mm -103.51 150.17 7.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.746 0.308 . . . . 0.0 110.8 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -114.32 134.72 11.92 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.234 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 19.8 mttt -54.33 147.07 14.17 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.75 0.31 . . . . 0.0 110.877 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.739 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.2 p -115.0 -162.98 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.346 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.739 ' H ' HG22 ' A' ' 66' ' ' VAL . 52.1 t0 -178.69 76.58 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.102 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.467 ' OE2' HG11 ' A' ' 81' ' ' VAL . 48.1 mt-10 -53.71 -23.83 12.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.424 -179.393 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 42.3 m -61.93 -15.39 42.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.104 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.5 mmtp -64.02 -45.09 90.48 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.753 0.311 . . . . 0.0 111.067 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.9 mmtt 64.09 95.83 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.893 0.377 . . . . 0.0 110.79 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 26.1 mmt85 -106.54 146.99 29.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.849 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -104.04 145.16 30.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.966 0.413 . . . . 0.0 110.969 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 43.6 p30 -87.6 176.91 7.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.991 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -65.1 -16.97 64.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.357 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -86.43 6.66 29.22 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.518 -179.831 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.16 9.65 86.68 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.759 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.2 m-80 -101.31 161.15 13.83 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.763 0.316 . . . . 0.0 110.775 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -90.51 150.42 21.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.887 0.375 . . . . 0.0 110.927 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.469 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.7 m -140.5 158.72 24.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.167 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.467 HG11 ' OE2' ' A' ' 68' ' ' GLU . 20.4 t -86.72 108.89 20.16 Favored Pre-proline 0 C--N 1.326 -0.45 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 178.462 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.469 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 78.2 Cg_exo -50.23 145.29 20.94 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.111 1.874 . . . . 0.0 112.466 -178.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.466 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 7.4 mtpt -110.66 151.56 42.9 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.054 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 15.1 Cg_exo -73.41 155.03 50.98 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 C-N-CA 123.589 2.859 . . . . 0.0 112.642 -178.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -87.13 155.35 20.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.413 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 18.4 ttp180 -141.79 119.72 11.97 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.749 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 4.9 m80 -94.64 136.33 35.06 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.221 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.69 ' SD ' HG21 ' B' ' 50' ' ' ILE . 0.3 OUTLIER -120.48 112.14 18.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.914 0.388 . . . . 0.0 111.541 -179.5 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.753 ' CD2' HD11 ' A' ' 16' ' ' ILE . 86.4 m-85 -118.12 125.19 49.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.156 179.16 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -95.06 128.8 42.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.968 0.413 . . . . 0.0 111.236 -179.502 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.669 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 75.2 m-85 -113.44 145.55 40.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.81 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -107.75 25.3 11.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.911 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.52 ' HB3' HG23 ' A' ' 96' ' ' VAL . 0.5 OUTLIER -151.91 108.6 3.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.519 179.772 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 24.3 mtm-85 -52.0 -29.38 20.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.231 -179.671 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.12 -54.99 5.83 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.464 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.52 HG23 ' HB3' ' A' ' 93' ' ' ASN . 46.0 t -54.25 -47.14 68.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.813 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.5 ' HB2' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -61.39 -34.36 75.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.964 0.412 . . . . 0.0 110.21 179.337 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.427 ' O ' ' HB3' ' A' ' 102' ' ' MET . 50.6 t0 -63.63 -33.61 76.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.78 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 38.2 m-80 -67.45 -36.96 82.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.168 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.525 HD12 ' CG2' ' A' ' 16' ' ' ILE . 22.8 mm -66.31 -49.22 77.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.739 179.66 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.525 ' HB2' HD11 ' A' ' 48' ' ' LEU . 0.3 OUTLIER -65.27 -27.52 68.69 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.726 179.989 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.427 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -78.71 -40.91 32.36 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.165 179.654 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.437 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -74.23 -39.6 62.96 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.755 -179.898 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.71 ' HA ' HD12 ' A' ' 107' ' ' ILE . 13.2 mt -62.01 -41.03 97.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.714 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.77 ' HA ' HD12 ' A' ' 108' ' ' ILE . 6.1 mt-30 -62.95 -27.28 69.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.994 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -70.47 -32.01 69.37 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.96 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.055 HD13 HD13 ' A' ' 42' ' ' LEU . 5.8 mt -75.93 -46.19 35.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.504 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.77 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.0 mt -56.67 -61.34 1.25 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.585 0 CA-C-O 121.742 0.782 . . . . 0.0 109.635 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 11.5 t -51.0 -28.8 10.74 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.43 -1.259 . . . . 0.0 110.373 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.37 -40.13 95.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.344 179.411 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -84.14 -29.81 26.39 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.28 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.487 ' HE2' HG22 ' A' ' 108' ' ' ILE . 9.7 mttm -63.04 -43.59 98.24 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.496 179.502 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -58.48 -36.56 73.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.948 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.03 -32.87 74.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.107 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 . . . . . 0 C--O 1.248 0.993 0 CA-C-O 118.167 -0.921 . . . . 0.0 110.883 -179.975 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 7.9 mp . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.918 0.389 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -127.02 157.42 72.08 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.829 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_exo -52.02 -39.61 69.44 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.601 2.201 . . . . 0.0 112.342 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 93.3 m-20 -57.58 -26.72 61.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.846 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -77.58 -43.08 32.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.318 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.69 HG21 ' SD ' ' A' ' 88' ' ' MET . 33.0 mm -70.64 -31.98 47.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.801 -179.4 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -73.1 -28.5 62.32 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.03 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -66.5 -24.2 66.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.131 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 53' ' ' TRP . . . . . 0.403 ' CD2' ' HD2' ' A' ' 57' ' ' LYS . 17.6 m0 -51.86 -29.75 20.9 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.038 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 54' ' ' PHE . . . . . 0.426 ' CZ ' ' HB2' ' A' ' 61' ' ' ARG . 89.2 m-85 -95.8 -25.66 15.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.122 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -78.65 -29.72 45.94 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.866 0.365 . . . . 0.0 110.856 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -79.69 132.93 36.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.998 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -129.16 77.12 78.23 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.932 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo . . . . . 0 C--O 1.249 1.045 0 C-N-CA 122.485 2.123 . . . . 0.0 112.387 179.981 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo . . . . . 0 N--CA 1.476 0.46 0 CA-C-O 120.91 0.296 . . . . 0.0 111.943 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.5 p -76.37 -12.12 60.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.377 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.422 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 74.5 m80 -153.03 36.0 0.48 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.154 0.502 . . . . 0.0 110.917 -179.71 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.476 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 11.7 p -175.04 134.21 0.33 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.649 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -162.2 119.29 0.87 Allowed Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.417 179.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.648 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -43.86 106.12 0.06 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.204 0.526 . . . . 0.0 111.298 -179.612 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.741 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -120.15 152.08 38.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.916 -178.862 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.541 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -100.1 124.79 53.78 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.252 0 CA-C-O 120.959 0.409 . . . . 0.0 110.241 178.876 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.507 ' HB3' ' CZ3' ' A' ' 29' ' ' TRP . 27.3 t80 -112.25 130.43 55.93 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.19 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.427 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 88.9 mt-10 55.24 34.83 23.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.906 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.9 mtpt 76.1 1.3 3.43 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.353 -179.096 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.528 ' O ' HG23 ' A' ' 8' ' ' ILE . 41.4 t -99.38 154.98 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.643 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.881 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.541 ' HA ' HG13 ' A' ' 8' ' ' ILE . 90.4 p -96.65 148.96 22.33 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-O 121.562 0.696 . . . . 0.0 112.595 -178.691 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.447 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.31 -179.68 46.39 Favored Glycine 0 N--CA 1.445 -0.749 0 CA-C-N 114.569 -1.196 . . . . 0.0 110.181 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.648 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.9 143.19 18.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 117.632 0.716 . . . . 0.0 110.637 179.47 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.823 HG12 HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -106.76 118.63 54.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 179.571 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -119.03 129.13 54.95 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.168 0.508 . . . . 0.0 111.409 -178.556 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.48 HD12 ' CG2' ' A' ' 103' ' ' THR . 54.0 mt -102.9 140.07 22.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.934 -179.324 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 47.2 t-20 -132.48 111.42 11.26 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.913 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -93.23 4.64 53.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.247 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -78.95 -17.55 55.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.004 0.43 . . . . 0.0 110.437 179.285 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.64 140.75 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.92 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.443 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.5 t -112.94 116.93 46.93 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.767 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.443 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 1.1 Cg_endo -81.5 142.68 55.46 Favored 'Cis proline' 0 C--N 1.347 0.493 0 C-N-CA 123.878 -1.301 . . . . 0.0 112.054 0.082 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.58 142.85 5.53 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.88 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 72.9 mt-10 -136.03 167.19 21.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.126 0.489 . . . . 0.0 111.552 -179.58 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.823 HD21 HG12 ' A' ' 16' ' ' ILE . 5.3 tt -121.15 129.14 53.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.854 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.5 m -117.05 127.64 54.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.105 0.479 . . . . 0.0 112.011 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.507 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 57.0 t90 -100.57 130.05 46.58 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.111 179.151 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.5 ttt180 -124.97 116.29 21.93 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.938 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.447 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 10.6 m -45.45 163.85 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.042 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.88 -41.5 67.94 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 121.497 0.665 . . . . 0.0 109.551 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.2 t0 -83.3 -20.74 33.86 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.046 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.26 34.3 12.66 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.34 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -100.99 -21.24 15.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.572 0.225 . . . . 0.0 111.505 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.41 144.23 46.41 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.931 0.396 . . . . 0.0 111.329 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 11.7 p -139.4 137.76 40.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.011 179.374 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.498 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 13.6 t60 -132.31 145.53 51.34 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.859 0.361 . . . . 0.0 111.169 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 45.2 m -129.16 135.58 49.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.998 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.4 t -130.07 140.95 47.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.007 0.432 . . . . 0.0 111.642 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.51 ' CG1' HG23 ' A' ' 44' ' ' THR . 7.0 p -87.99 117.47 31.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.367 178.364 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.948 HD13 ' CD1' ' A' ' 107' ' ' ILE . 18.7 mt -76.02 -33.26 59.66 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -178.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.402 ' CB ' ' HB3' ' A' ' 24' ' ' PRO . 39.4 t -57.18 -19.69 22.16 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.495 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.51 HG23 ' CG1' ' A' ' 41' ' ' VAL . 0.2 OUTLIER -101.58 -22.45 14.48 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.346 -179.614 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.573 HD12 ' HB3' ' A' ' 62' ' ' LEU . 39.8 mm -47.87 95.19 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.047 0.451 . . . . 0.0 110.999 -179.673 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -66.73 -26.77 67.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.625 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.766 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 19.1 mttm -148.14 152.6 37.57 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.149 0.5 . . . . 0.0 111.942 -179.227 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.551 HD22 ' N ' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -133.95 128.53 34.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.613 179.178 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -133.58 152.83 51.97 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.067 0.46 . . . . 0.0 111.437 -179.109 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -148.08 153.19 38.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.729 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 37.4 p -75.8 118.82 73.88 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.548 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -64.1 159.11 44.4 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.491 2.127 . . . . 0.0 112.565 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.93 -41.52 98.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.087 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.7 t -57.92 -27.48 63.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.845 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.9 t -85.97 117.91 25.12 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.83 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -57.15 -18.28 14.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.532 179.338 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.414 ' HD2' ' CE3' ' B' ' 53' ' ' TRP . 21.0 mmtm -74.94 140.54 43.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.935 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.402 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 10.7 mmm -120.44 115.47 23.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.444 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.64 169.13 1.72 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.112 0.482 . . . . 0.0 111.839 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.419 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -145.73 134.07 21.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.982 179.519 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.408 ' HD2' ' CE1' ' B' ' 54' ' ' PHE . 15.2 mtt180 -125.45 133.1 52.57 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.072 0.463 . . . . 0.0 112.138 -179.136 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.573 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -112.97 131.23 55.84 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.128 179.292 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.766 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.2 mm -99.75 149.99 5.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.77 0.319 . . . . 0.0 111.069 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -120.53 137.74 12.33 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.37 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 24.0 mttp -53.7 141.92 24.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.871 0.367 . . . . 0.0 111.118 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.759 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.4 p -119.57 -161.52 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.799 179.793 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.759 ' H ' HG22 ' A' ' 66' ' ' VAL . 23.8 t0 -165.76 58.94 0.11 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.399 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -57.78 -22.41 46.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.253 -179.552 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 40.8 m -61.24 -16.62 47.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.959 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.4 mtmt -74.45 -35.83 63.34 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.087 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.1 mttt 61.96 93.63 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.684 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 25.8 mmt85 -95.79 141.41 29.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.103 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 43.8 mmtt -89.9 145.64 24.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.956 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -93.07 172.21 8.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.839 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -60.32 -19.97 57.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.185 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -86.29 4.29 39.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.405 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.92 15.25 81.43 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.676 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -111.39 144.68 40.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.923 0.392 . . . . 0.0 110.967 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -70.73 148.99 47.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.038 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.46 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.4 m -134.17 158.94 42.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.03 179.815 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 33.6 t -100.23 98.99 8.54 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.103 -0.498 . . . . 0.0 109.781 178.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.46 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 85.3 Cg_exo -40.07 148.14 0.18 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.721 2.281 . . . . 0.0 113.034 -179.02 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.513 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -115.72 107.35 48.68 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.012 -179.938 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.58 ' HD3' HG21 ' A' ' 66' ' ' VAL . 1.8 Cg_endo -39.09 141.88 0.37 Allowed 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 123.543 2.829 . . . . 0.0 112.585 179.371 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 59.7 mm-40 -65.48 126.34 27.97 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.773 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -122.48 120.42 33.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.931 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.437 ' HB3' ' CE2' ' A' ' 89' ' ' PHE . 94.0 m-70 -98.57 139.23 34.6 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.578 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -121.53 107.86 12.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.256 -179.644 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.597 ' CD1' HD11 ' A' ' 16' ' ' ILE . 95.5 m-85 -114.94 125.43 53.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.462 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.02 136.15 35.69 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.019 0.437 . . . . 0.0 111.136 -179.57 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.741 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 92.5 m-85 -123.69 158.69 31.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.844 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.402 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 68.8 m-20 -115.56 -19.81 10.44 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.405 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -107.33 114.64 28.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.797 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 9.8 mtt85 -57.83 -29.22 64.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.07 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -77.02 -55.15 5.71 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.361 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.6 t -56.85 -45.29 83.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.934 0.397 . . . . 0.0 110.675 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.411 ' HB3' ' CB ' ' A' ' 91' ' ' PHE . 3.9 ppp? -63.84 -36.81 85.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.053 179.142 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -62.52 -33.3 74.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.446 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -67.18 -33.73 76.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.987 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.543 HG22 HD12 ' A' ' 104' ' ' LEU . 17.5 mm -69.83 -48.71 62.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.642 179.346 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.428 ' HA ' HD11 ' A' ' 48' ' ' LEU . 8.5 ptpt -64.4 -27.72 69.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.849 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.7 -41.2 31.7 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.447 179.713 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.48 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -77.21 -30.85 54.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.691 179.876 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.682 ' CD2' HD22 ' A' ' 42' ' ' LEU . 13.5 mt -71.07 -38.63 72.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.788 179.786 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.722 ' HA ' HD12 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -68.4 -29.24 67.88 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.568 179.792 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -71.28 -33.59 69.89 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.709 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.948 ' CD1' HD13 ' A' ' 42' ' ' LEU . 16.3 mt -70.2 -47.96 64.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.016 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.935 HG22 ' CD ' ' A' ' 112' ' ' LYS . 2.7 mt -57.79 -61.07 1.46 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.631 0 CA-C-O 121.862 0.839 . . . . 0.0 109.224 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 27.3 m -50.2 -28.81 8.15 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.376 179.1 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -65.11 -35.31 80.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.785 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.4 ' CZ ' ' HB2' ' A' ' 43' ' ' SER . 69.1 m-85 -89.53 -31.09 17.79 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.04 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.935 ' CD ' HG22 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -64.48 -34.11 77.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.586 179.615 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 49.1 t0 -59.11 -37.61 77.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.949 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.97 -33.65 75.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.112 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.964 179.974 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 27.7 tp . . . . . 0 N--CA 1.488 1.429 0 CA-C-O 120.747 0.308 . . . . 0.0 111.154 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 2.1 m -128.28 165.83 28.29 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.875 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_exo -51.91 -44.11 47.37 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.568 2.179 . . . . 0.0 112.316 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -58.25 -29.17 65.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.839 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -63.21 -44.09 96.3 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.766 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 35.4 mm -67.29 -25.35 33.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.244 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -64.26 -32.91 74.68 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.882 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.18 -29.25 67.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.2 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 53' ' ' TRP . . . . . 0.414 ' CE3' ' HD2' ' A' ' 57' ' ' LYS . 12.6 m95 -53.56 -29.69 38.32 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.965 0.412 . . . . 0.0 110.894 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 54' ' ' PHE . . . . . 0.408 ' CE1' ' HD2' ' A' ' 61' ' ' ARG . 96.4 m-85 -94.68 -25.08 16.88 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.99 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.439 HG22 ' N ' ' B' ' 56' ' ' GLU . 0.8 OUTLIER -82.24 -55.42 4.55 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.77 179.988 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.439 ' N ' HG22 ' B' ' 55' ' ' THR . 95.9 mt-10 -76.64 148.2 37.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.861 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -122.69 76.97 47.53 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.924 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo . . . . . 0 C--O 1.249 1.037 0 C-N-CA 122.57 2.18 . . . . 0.0 112.34 179.997 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_exo . . . . . 0 N--CA 1.477 0.537 0 CA-C-O 121.137 0.39 . . . . 0.0 111.879 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.6 p -79.07 131.35 36.23 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.854 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.405 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 33.3 m80 65.15 32.97 9.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.229 0.537 . . . . 0.0 111.204 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.562 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 72.6 p 177.65 142.72 0.09 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.665 179.158 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -177.88 114.48 0.46 Allowed Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.327 179.811 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.649 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -44.72 100.12 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.204 0.526 . . . . 0.0 111.327 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.845 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -115.71 152.03 33.98 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.066 -178.897 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.567 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -97.7 124.04 50.45 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.193 178.922 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.523 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 18.7 t80 -112.03 130.31 55.91 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.186 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.425 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 38.9 mt-10 56.07 34.92 24.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.872 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 mtpm? 76.18 0.67 3.31 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.25 -178.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.526 ' O ' HG23 ' A' ' 8' ' ' ILE . 41.3 t -99.92 155.41 4.18 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.713 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.784 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.567 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -96.87 149.86 21.39 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 121.379 0.609 . . . . 0.0 112.48 -178.75 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.453 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 174.83 -179.76 45.93 Favored Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.511 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.649 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.96 141.11 22.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 117.68 0.74 . . . . 0.0 110.457 179.307 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.662 HD11 ' CE1' ' A' ' 89' ' ' PHE . 0.1 OUTLIER -106.71 118.31 54.2 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 CA-C-N 115.312 -0.858 . . . . 0.0 108.685 179.737 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.436 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -119.75 138.57 53.24 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.201 -178.605 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.515 HG21 HD11 ' A' ' 107' ' ' ILE . 96.4 mt -112.78 140.08 34.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.327 -178.872 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -127.08 114.01 17.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.903 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -86.86 5.85 34.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.279 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -79.36 -17.54 54.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.868 0.366 . . . . 0.0 110.426 179.375 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.02 152.0 5.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.984 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.425 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.2 t -129.73 114.74 17.94 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.883 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.425 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 57.5 Cg_endo -72.82 147.25 89.05 Favored 'Cis proline' 0 C--N 1.349 0.578 0 C-N-CA 123.296 -1.543 . . . . 0.0 111.955 0.121 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.713 ' O ' HD22 ' A' ' 42' ' ' LEU . . . -45.44 136.85 5.27 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.557 179.631 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -116.95 152.94 33.51 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.376 0.608 . . . . 0.0 112.03 -178.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.895 ' CB ' HD11 ' A' ' 42' ' ' LEU . 2.9 tt -121.3 130.6 53.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.147 179.166 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.9 m -120.52 127.33 52.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.159 0.504 . . . . 0.0 112.049 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.523 ' CH2' ' HB3' ' A' ' 9' ' ' PHE . 60.6 t90 -100.56 126.77 47.04 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.706 179.044 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 38.1 ttt180 -121.35 116.56 25.04 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.854 0.359 . . . . 0.0 110.875 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.466 ' HG ' ' H ' ' A' ' 36' ' ' LYS . 0.9 OUTLIER -45.48 166.92 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.083 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.87 -42.04 61.34 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 121.541 0.686 . . . . 0.0 109.702 179.657 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -82.69 -20.68 35.65 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.837 -1.074 . . . . 0.0 111.121 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.47 34.4 12.05 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.292 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -103.9 -19.71 14.15 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 -179.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.466 ' H ' ' HG ' ' A' ' 31' ' ' SER . 0.0 OUTLIER -135.06 144.04 47.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.892 0.377 . . . . 0.0 111.372 -179.855 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 47.5 t -139.52 140.04 37.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.037 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.497 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 31.6 t-80 -134.33 146.22 49.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.052 179.704 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.439 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 46.4 m -129.15 135.91 49.49 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.337 -179.72 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 84.7 t -139.24 140.54 37.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 CA-C-O 121.066 0.46 . . . . 0.0 111.645 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.637 HG22 HG23 ' A' ' 44' ' ' THR . 1.9 p -88.31 117.6 32.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 177.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.895 HD11 ' CB ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -74.28 -35.91 63.76 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -178.277 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.401 ' CB ' ' HB2' ' A' ' 24' ' ' PRO . 8.3 m -50.04 -25.94 3.88 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -178.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.637 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -87.17 -23.52 24.78 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.167 -179.668 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.829 HD12 ' HB3' ' A' ' 62' ' ' LEU . 44.3 mm -50.05 96.66 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.129 0.49 . . . . 0.0 110.917 -179.781 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.423 ' N ' ' O ' ' A' ' 63' ' ' ILE . 16.7 t0 -72.44 -22.93 61.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.954 -179.232 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.452 ' HB2' HG13 ' A' ' 63' ' ' ILE . 43.4 mttm -157.27 137.91 13.12 Favored 'General case' 0 CA--C 1.522 -0.133 0 C-N-CA 120.422 -0.511 . . . . 0.0 111.949 -179.449 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.629 HD21 HD13 ' A' ' 104' ' ' LEU . 15.3 mt -106.34 124.04 48.99 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.903 178.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 91.9 mm-40 -115.51 133.26 56.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.801 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.428 ' HB2' HD11 ' A' ' 60' ' ' LEU . . . -142.99 146.34 33.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.057 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.676 HG23 ' O ' ' A' ' 59' ' ' MET . 74.9 p -75.63 130.56 78.94 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.687 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -67.02 160.21 48.35 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.49 2.127 . . . . 0.0 112.519 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.07 -42.87 95.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.02 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 87.1 p -60.63 -26.47 67.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.773 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.6 m -77.36 120.16 21.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.861 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -56.98 -18.1 12.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.409 179.225 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -67.28 155.96 37.57 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.956 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.418 ' HE1' ' O ' ' A' ' 92' ' ' ASN . 44.0 mtp -142.96 80.5 1.69 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.725 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.676 ' O ' HG23 ' A' ' 51' ' ' THR . 10.4 tmm? -162.35 149.37 13.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.453 -179.629 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.428 HD11 ' HB2' ' A' ' 50' ' ' ALA . 0.2 OUTLIER -116.35 152.98 32.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.479 179.771 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.446 ' HB2' ' CE2' ' B' ' 54' ' ' PHE . 56.2 ttt180 -137.91 135.41 36.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.995 0.426 . . . . 0.0 111.886 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.829 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -103.53 144.24 31.68 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.384 179.501 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.452 HG13 ' HB2' ' A' ' 47' ' ' LYS . 1.2 mm -116.47 122.65 70.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.059 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.63 151.92 20.56 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.415 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.8 mttt -70.47 136.41 49.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.845 0.355 . . . . 0.0 111.001 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.488 ' CG2' ' N ' ' A' ' 67' ' ' ASP . 1.4 p -70.15 160.51 5.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.299 0.571 . . . . 0.0 111.312 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.488 ' N ' ' CG2' ' A' ' 66' ' ' VAL . 0.5 OUTLIER -113.18 130.69 56.13 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.784 179.901 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -95.0 3.63 54.71 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.453 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 24.0 t -72.08 -9.99 59.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.326 -179.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.71 -69.1 0.77 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.757 0.313 . . . . 0.0 111.176 -179.758 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.6 mmtt 62.47 94.23 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.788 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 16.6 mtt-85 -108.17 153.13 23.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.037 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.5 mmtp -93.28 147.73 22.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.986 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -90.47 176.71 6.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.005 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -63.75 -18.67 64.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.272 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -88.57 -5.89 57.9 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.344 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 91.88 9.52 62.4 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.711 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 -105.95 145.15 31.67 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.892 0.377 . . . . 0.0 110.965 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -72.3 144.08 48.48 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.915 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.44 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.3 m -132.3 158.82 43.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.175 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 32.5 t -101.5 98.8 9.95 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.678 178.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.44 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 99.2 Cg_exo -42.0 158.54 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.597 2.198 . . . . 0.0 112.743 -179.113 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.447 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.1 OUTLIER -69.86 149.96 96.51 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-O 121.115 0.483 . . . . 0.0 111.055 -179.874 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 16.8 Cg_exo -72.34 164.14 36.52 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 123.473 2.782 . . . . 0.0 112.622 -179.073 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 -65.55 157.36 29.93 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.692 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 62.3 mtm180 -150.11 119.82 7.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.799 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.433 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 36.2 m-70 -105.32 159.06 16.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.465 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.571 ' HG3' HG21 ' B' ' 50' ' ' ILE . 0.0 OUTLIER -126.67 144.6 50.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.213 0.53 . . . . 0.0 111.681 -179.503 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.662 ' CE1' HD11 ' A' ' 16' ' ' ILE . 97.7 m-85 -157.51 125.21 5.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.119 179.406 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 22.6 t -109.36 139.86 43.79 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.899 0.381 . . . . 0.0 111.387 -179.444 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.845 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 0.8 OUTLIER -126.76 146.57 50.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.521 179.681 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.418 ' O ' ' HE1' ' A' ' 58' ' ' MET . 10.9 m120 -87.21 -18.04 31.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.312 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.461 ' HB2' HG23 ' A' ' 96' ' ' VAL . 94.8 m-20 -109.43 119.43 39.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.819 0.343 . . . . 0.0 110.741 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.62 -31.83 66.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.986 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.91 -46.73 73.92 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.168 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.461 HG23 ' HB2' ' A' ' 93' ' ' ASN . 48.3 t -59.86 -34.2 55.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.484 179.788 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.478 ' HG2' ' CG ' ' A' ' 91' ' ' PHE . 0.2 OUTLIER -63.59 -37.55 87.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.523 179.568 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -71.06 -36.61 72.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.86 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -60.22 -47.39 86.16 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.762 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.524 HG22 HD12 ' A' ' 104' ' ' LEU . 24.5 mm -65.46 -48.98 80.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.888 179.688 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.23 -27.61 68.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.898 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 44.6 mtm -78.65 -37.79 41.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.466 179.632 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.485 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -79.43 -38.97 33.49 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.744 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.629 HD13 HD21 ' A' ' 48' ' ' LEU . 30.2 mt -64.7 -39.62 93.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.591 179.761 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.593 ' HA ' HD12 ' A' ' 108' ' ' ILE . 48.3 mt-30 -61.92 -31.09 71.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.519 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -68.52 -35.45 77.49 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.666 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.664 HG21 ' HB2' ' A' ' 42' ' ' LEU . 58.2 mt -68.22 -48.49 73.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.957 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.807 HG22 ' HD3' ' A' ' 112' ' ' LYS . 2.7 mt -59.93 -61.07 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.508 -0.668 0 CA-C-O 121.663 0.744 . . . . 0.0 109.06 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.5 m -49.74 -28.94 6.81 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.248 -1.342 . . . . 0.0 110.81 179.186 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 31.3 mtt-85 -66.97 -34.8 78.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.707 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -96.41 -30.62 13.27 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.888 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.807 ' HD3' HG22 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -68.68 -37.53 79.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.626 179.693 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -61.12 -37.3 82.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.887 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.02 -33.95 76.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.13 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 86.9 m-20 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.272 -0.87 . . . . 0.0 110.937 179.962 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 52.0 mt . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.855 0.36 . . . . 0.0 111.199 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 16.2 p -117.42 159.49 41.57 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.9 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -52.82 -39.33 77.93 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.603 2.202 . . . . 0.0 112.319 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -56.33 -26.46 52.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.962 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -63.07 -41.72 99.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.779 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.571 HG21 ' HG3' ' A' ' 88' ' ' MET . 36.9 mm -68.77 -27.02 34.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.242 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -66.27 -34.45 78.02 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.921 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.87 -31.44 72.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.858 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 53' ' ' TRP . . . . . . . . . . . . . 12.3 m95 -58.5 -34.73 71.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.98 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 54' ' ' PHE . . . . . 0.446 ' CE2' ' HB2' ' A' ' 61' ' ' ARG . 89.5 m-85 -101.82 -13.77 17.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.215 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -89.09 -25.99 21.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.967 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -56.04 145.83 24.44 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.08 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -105.08 155.34 37.84 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.872 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo . . . . . 0 C--O 1.25 1.111 0 C-N-CA 122.538 2.159 . . . . 0.0 112.307 179.974 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo . . . . . 0 N--CA 1.476 0.451 0 CA-C-O 120.887 0.286 . . . . 0.0 111.781 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.0 m -158.33 -50.18 0.06 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.847 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.412 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 78.0 m80 -137.9 34.02 2.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.174 0.511 . . . . 0.0 110.828 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.521 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 49.9 p 179.97 120.43 0.06 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.709 179.103 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.417 ' O ' ' C ' ' A' ' 6' ' ' ALA . . . -147.4 115.75 0.79 Allowed Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.781 -0.723 . . . . 0.0 111.963 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.554 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -34.2 118.68 0.39 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.794 0.33 . . . . 0.0 111.116 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.583 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -133.46 150.98 51.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.075 -178.734 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.613 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.4 mp -99.83 124.57 53.31 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 CA-C-O 121.157 0.503 . . . . 0.0 110.521 179.227 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.504 ' HB3' ' CZ3' ' A' ' 29' ' ' TRP . 18.2 t80 -116.62 132.53 56.66 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.033 179.847 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.426 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 89.7 mt-10 57.41 33.48 23.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.741 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.5 mttm 75.29 1.24 3.65 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.001 -178.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.483 ' O ' HG23 ' A' ' 8' ' ' ILE . 25.0 t -101.0 144.37 12.94 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.769 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.752 179.078 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.613 ' HA ' HG13 ' A' ' 8' ' ' ILE . 81.0 p -83.72 145.6 28.65 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.278 -179.568 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.442 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . -174.3 -179.12 44.71 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.844 -179.377 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.554 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 4.5 mm -105.37 135.27 44.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-O 120.914 0.388 . . . . 0.0 110.373 179.74 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.583 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.2 OUTLIER -106.44 118.01 53.3 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.884 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 178.634 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.459 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -122.08 128.69 51.63 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.345 0.593 . . . . 0.0 111.84 -177.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.412 ' O ' ' HB3' ' A' ' 3' ' ' HIS . 59.8 mt -101.77 140.01 21.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.787 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.461 ' ND2' HG21 ' A' ' 22' ' ' VAL . 50.2 p-10 -131.27 111.47 11.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.999 0.428 . . . . 0.0 111.168 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -92.4 4.01 54.29 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.419 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -78.35 -17.71 56.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.962 0.41 . . . . 0.0 110.414 179.332 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.461 HG21 ' ND2' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -100.88 151.32 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.015 -179.719 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.44 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.1 t -123.67 117.56 27.53 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.642 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.453 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 1.6 Cg_endo -79.74 145.65 73.81 Favored 'Cis proline' 0 C--N 1.348 0.517 0 C-N-CA 123.678 -1.384 . . . . 0.0 112.044 0.008 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.21 145.86 2.11 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.714 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -137.41 167.05 22.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.307 0.575 . . . . 0.0 111.983 -179.126 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.592 ' C ' HD23 ' A' ' 27' ' ' LEU . 5.4 tt -125.86 124.67 41.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.388 179.2 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.5 m -116.69 130.53 56.79 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.147 0.499 . . . . 0.0 112.056 -178.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.504 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 58.7 t90 -100.63 129.01 46.49 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.241 179.096 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 45.4 ttt-85 -127.75 116.99 21.07 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.504 179.562 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.401 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 14.5 m -44.66 155.96 0.09 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.952 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.42 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -65.4 -39.35 92.07 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.638 0.732 . . . . 0.0 109.25 179.978 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -85.03 -23.1 28.76 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 114.68 -1.146 . . . . 0.0 111.129 179.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.85 32.06 10.43 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.601 179.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -94.71 -21.86 18.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.592 0.234 . . . . 0.0 111.48 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.47 147.02 44.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.902 0.382 . . . . 0.0 111.17 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 14.7 p -139.13 138.14 41.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.126 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -136.44 145.87 45.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.984 0.421 . . . . 0.0 111.173 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 40.3 m -129.2 137.25 51.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.998 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 88.2 t -134.1 140.85 45.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 121.186 0.517 . . . . 0.0 111.754 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.598 HG22 HG23 ' A' ' 44' ' ' THR . 1.7 p -87.95 117.77 32.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 178.024 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.998 HD13 HD13 ' A' ' 107' ' ' ILE . 58.2 mt -75.21 -29.66 60.39 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -178.607 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.453 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 8.1 t -55.86 -22.16 23.76 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.109 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.598 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -94.8 -21.63 18.59 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.137 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.868 HD12 ' HB3' ' A' ' 62' ' ' LEU . 39.3 mm -57.95 88.26 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.983 0.421 . . . . 0.0 110.922 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -70.04 -29.06 66.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.383 -179.527 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.68 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 18.2 mttm -138.99 142.36 38.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.969 0.414 . . . . 0.0 111.575 -179.294 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.722 HD23 ' HG2' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -124.71 124.41 42.11 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.609 179.134 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -116.82 139.32 50.74 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.049 -179.205 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.509 ' HB3' ' CE ' ' A' ' 101' ' ' LYS . . . -143.39 144.22 31.96 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.969 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 32.3 p -75.65 113.44 26.67 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.548 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.46 160.57 35.02 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.545 2.164 . . . . 0.0 112.643 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.01 -42.97 77.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.243 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.5 m -58.29 -27.63 64.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.725 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 23.4 t -85.06 118.2 24.49 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.891 179.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -56.22 -18.7 11.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.583 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.432 ' HD2' ' CE3' ' B' ' 53' ' ' TRP . 39.6 mmtm -65.44 159.03 25.18 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.871 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.438 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 26.8 mtp -142.92 79.92 1.67 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.819 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.455 ' CE ' ' CE3' ' B' ' 53' ' ' TRP . 29.3 mtm -154.7 169.09 24.72 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.152 0.501 . . . . 0.0 111.633 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.453 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -140.79 123.88 16.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.529 -0.759 . . . . 0.0 109.955 179.502 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 47.1 ttt180 -113.43 137.11 52.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.853 0.358 . . . . 0.0 111.789 -179.258 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.868 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -112.61 144.08 42.71 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.624 179.749 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.68 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 2.0 mm -114.79 124.32 71.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.025 179.582 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -90.37 129.93 9.99 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.466 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 48.3 mttt -45.9 152.43 0.37 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.738 0.304 . . . . 0.0 111.284 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.704 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.0 OUTLIER -122.23 -162.89 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.865 -179.944 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.704 ' H ' HG22 ' A' ' 66' ' ' VAL . 9.7 t0 179.67 51.52 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.402 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.598 ' OE2' HG12 ' A' ' 81' ' ' VAL . 50.8 mt-10 -57.5 -22.3 43.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.402 -179.57 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.9 m -63.89 -14.26 52.01 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.135 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.2 mtmt -70.14 -45.47 66.75 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.846 0.355 . . . . 0.0 111.307 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.1 mttm 61.42 93.31 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.672 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.83 151.44 25.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.001 -179.794 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.6 mmtm -86.16 145.44 27.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.076 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 43.7 p30 -95.77 177.45 5.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.896 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -60.28 -19.98 57.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.337 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -88.45 9.75 22.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.513 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 70.31 17.86 74.6 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.696 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 35.2 m120 -115.52 145.87 42.23 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.862 0.363 . . . . 0.0 110.754 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 55.7 mp0 -74.56 142.5 44.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.97 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.478 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.0 m -131.36 158.88 43.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.01 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.598 HG12 ' OE2' ' A' ' 68' ' ' GLU . 15.4 t -102.29 98.52 10.67 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.712 178.778 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.478 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 87.2 Cg_exo -45.83 163.49 0.09 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.493 2.129 . . . . 0.0 112.578 -179.089 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.462 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 21.5 mtpp -117.99 147.74 41.96 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.97 0.414 . . . . 0.0 110.991 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 16.5 Cg_exo -72.7 136.27 25.29 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 123.363 2.708 . . . . 0.0 112.665 -179.045 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 40.0 mm-40 -67.01 149.32 50.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.72 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.2 mtp85 -151.59 120.0 6.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.747 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -104.59 144.94 31.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.769 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.4 ttt -122.94 118.34 27.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.887 0.375 . . . . 0.0 111.224 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.492 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 93.7 m-85 -124.98 141.94 51.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.521 179.713 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 1.3 p -114.0 135.67 53.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.899 0.38 . . . . 0.0 111.054 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.496 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 23.8 m-85 -122.47 156.48 34.01 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.75 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.438 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 57.6 m-20 -118.78 20.3 12.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.111 179.713 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -147.9 110.2 4.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.844 0.354 . . . . 0.0 110.669 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 15.5 mtt-85 -54.46 -29.33 49.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.066 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -75.79 -55.04 6.01 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.356 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 46.6 t -56.08 -47.41 80.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.622 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.5 ppp? -63.06 -35.55 80.62 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.84 179.135 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -61.12 -35.19 76.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.397 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 19.3 m120 -67.9 -35.38 78.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.197 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.44 HG22 HD12 ' A' ' 104' ' ' LEU . 18.3 mm -70.73 -52.07 31.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.719 179.41 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.517 ' CG ' HD11 ' A' ' 48' ' ' LEU . 0.6 OUTLIER -61.58 -28.04 69.06 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.862 179.85 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 46.3 mtm -78.46 -40.81 34.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.655 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.15 -31.84 49.96 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.624 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.702 ' HA ' HD12 ' A' ' 107' ' ' ILE . 14.0 mt -65.94 -39.89 90.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.887 0.375 . . . . 0.0 110.661 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.777 ' HA ' HD12 ' A' ' 108' ' ' ILE . 1.4 mt-30 -63.1 -28.43 70.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.037 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -70.25 -36.85 74.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.052 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.998 HD13 HD13 ' A' ' 42' ' ' LEU . 6.0 mt -69.47 -46.98 74.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.356 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.817 HG22 ' CD ' ' A' ' 112' ' ' LYS . 2.3 mt -57.22 -61.11 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.597 0 CA-C-O 121.696 0.76 . . . . 0.0 109.584 179.278 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 29.9 m -51.51 -28.68 14.21 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.458 179.049 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 4.3 mtt-85 -66.27 -35.35 80.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.787 179.661 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.406 ' CZ ' ' HB2' ' A' ' 43' ' ' SER . 79.8 m-85 -93.13 -34.48 13.62 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.954 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.817 ' CD ' HG22 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -65.35 -37.09 85.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.982 0.42 . . . . 0.0 110.748 179.789 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -60.95 -38.68 86.73 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.0 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.04 -35.13 80.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.133 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 51.8 t0 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.218 -0.896 . . . . 0.0 111.002 179.873 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 7.3 tt . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.853 0.358 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 15.2 p -123.62 164.7 27.0 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.833 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_exo -51.83 -43.42 51.73 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.554 2.169 . . . . 0.0 112.35 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -59.02 -28.82 66.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.996 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -73.26 -49.1 29.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.164 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 34.4 mm -56.42 -31.66 33.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.528 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 19.0 pt-20 -80.48 -26.05 38.46 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.921 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.56 -30.72 70.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.637 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 53' ' ' TRP . . . . . 0.455 ' CE3' ' CE ' ' A' ' 59' ' ' MET . 13.0 m0 -58.05 -36.06 72.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.998 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 54' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -93.87 -0.77 55.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.434 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -76.39 -30.8 57.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.756 0.312 . . . . 0.0 110.812 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -59.7 138.31 57.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.903 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -167.56 75.13 0.97 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.923 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo . . . . . 0 C--O 1.249 1.042 0 C-N-CA 122.532 2.155 . . . . 0.0 112.234 -179.914 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo . . . . . 0 N--CA 1.477 0.551 0 CA-C-O 120.873 0.281 . . . . 0.0 111.797 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.8 m -148.03 123.68 10.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.024 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.458 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 52.3 m80 64.53 29.05 13.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.207 0.527 . . . . 0.0 111.367 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.502 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 0.9 OUTLIER -172.69 139.97 0.96 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.549 179.022 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.402 ' CA ' ' CG1' ' A' ' 96' ' ' VAL . . . -171.49 118.27 0.73 Allowed Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.319 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.647 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -47.84 100.2 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.18 0.514 . . . . 0.0 111.212 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.829 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -114.63 152.19 32.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.914 -178.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.555 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -100.57 123.72 53.68 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.259 0 CA-C-O 120.956 0.408 . . . . 0.0 110.414 178.998 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.502 ' HB3' ' CZ3' ' A' ' 29' ' ' TRP . 14.4 t80 -111.3 131.16 55.37 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.173 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.43 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 37.1 mt-10 54.85 34.94 23.15 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.936 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.5 mttm 75.84 1.78 3.58 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.35 -179.178 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.522 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.9 t -100.04 154.6 4.33 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.69 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 178.834 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.555 ' HA ' HG13 ' A' ' 8' ' ' ILE . 94.4 p -97.01 149.62 21.71 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.674 0.75 . . . . 0.0 112.776 -178.629 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.436 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 174.38 -179.84 45.46 Favored Glycine 0 N--CA 1.447 -0.623 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.241 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.647 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -107.15 141.93 21.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 117.801 0.801 . . . . 0.0 110.583 179.407 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.88 HG12 HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -106.73 118.43 54.44 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 CA-C-N 115.283 -0.871 . . . . 0.0 108.653 179.527 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.468 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -120.53 131.2 54.58 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.223 0.535 . . . . 0.0 111.213 -178.717 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.646 HG23 HD11 ' A' ' 42' ' ' LEU . 76.9 mt -103.25 140.22 22.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.207 -179.08 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -131.54 111.46 11.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.882 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -90.61 6.35 44.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.214 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -79.28 -17.88 53.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.9 0.381 . . . . 0.0 110.448 179.3 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -100.25 143.04 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.095 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.446 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.0 t -115.33 116.47 41.79 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.722 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.459 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 1.5 Cg_endo -80.8 143.24 61.68 Favored 'Cis proline' 0 C--N 1.348 0.525 0 C-N-CA 123.816 -1.327 . . . . 0.0 111.956 -0.013 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.26 142.42 2.91 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.053 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -135.61 167.3 21.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.191 0.519 . . . . 0.0 111.57 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.88 HD21 HG12 ' A' ' 16' ' ' ILE . 4.8 tt -121.04 130.94 53.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.806 179.595 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 48.0 m -117.74 126.01 51.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.199 0.524 . . . . 0.0 112.074 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.502 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 56.9 t90 -100.58 129.09 46.47 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.075 179.07 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 26.2 ttt85 -123.94 117.57 25.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.91 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.413 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 17.9 t -45.51 166.53 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.102 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.77 -42.64 57.81 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-O 121.452 0.644 . . . . 0.0 109.62 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -86.46 -16.62 36.54 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.079 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.8 34.24 13.82 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.238 -179.796 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -97.75 -21.62 16.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.573 0.225 . . . . 0.0 111.6 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.458 ' NZ ' HG21 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -138.99 146.76 41.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.027 0.442 . . . . 0.0 111.597 -179.892 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 47.5 t -139.56 140.49 36.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.769 179.293 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.5 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 38.1 t60 -135.55 145.58 47.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.023 0.44 . . . . 0.0 111.321 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 47.7 m -129.32 135.27 48.52 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.86 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.4 t -130.84 140.89 47.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 121.142 0.496 . . . . 0.0 111.612 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.623 HG22 HG23 ' A' ' 44' ' ' THR . 2.0 p -86.41 117.78 31.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 178.214 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 1.043 HD13 HD13 ' A' ' 107' ' ' ILE . 66.3 mt -75.39 -30.68 60.21 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.259 -0.428 . . . . 0.0 112.092 -178.618 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.459 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 11.4 t -55.64 -21.88 20.03 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 -178.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.623 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -94.41 -21.57 18.86 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.718 0.294 . . . . 0.0 111.36 -179.673 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.716 HD12 ' HB3' ' A' ' 62' ' ' LEU . 37.3 mm -51.76 92.71 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.97 0.414 . . . . 0.0 111.091 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -66.07 -29.73 70.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.109 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.634 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 18.2 mttp -153.35 158.99 42.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.977 0.418 . . . . 0.0 111.302 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.517 HD23 ' HG3' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -131.66 128.82 39.86 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.948 179.381 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -119.92 144.97 47.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.93 0.395 . . . . 0.0 111.072 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.812 ' HB2' HD12 ' A' ' 60' ' ' LEU . . . -148.06 141.63 25.47 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.033 179.884 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.53 HG21 ' HB3' ' A' ' 57' ' ' LYS . 73.3 p -75.69 117.17 61.6 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.587 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -62.05 160.56 29.57 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.519 2.146 . . . . 0.0 112.564 -179.659 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.67 -43.11 80.08 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.095 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 84.3 p -62.32 -27.48 69.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.053 0.454 . . . . 0.0 110.558 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.4 m -79.72 120.52 24.13 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.844 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.4 tp10 -55.62 -19.02 8.98 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.453 179.066 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.53 ' HB3' HG21 ' A' ' 51' ' ' THR . 0.0 OUTLIER -71.51 141.13 50.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.9 179.859 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 63.5 mtp -131.25 79.81 1.9 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.542 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 38.3 mtm -155.79 169.09 25.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.163 0.506 . . . . 0.0 111.527 -179.449 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.812 HD12 ' HB2' ' A' ' 50' ' ' ALA . 4.7 tp -134.17 124.03 25.34 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.113 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.439 ' HB2' ' CZ ' ' B' ' 54' ' ' PHE . 53.2 ttt180 -112.27 126.53 55.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.938 0.399 . . . . 0.0 111.783 -179.369 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.716 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -105.47 143.7 33.27 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.38 179.423 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.634 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.5 mm -108.78 121.98 62.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.744 0.307 . . . . 0.0 111.174 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -90.5 128.09 9.11 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.206 179.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 23.6 mttt -50.04 146.09 5.14 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.879 0.371 . . . . 0.0 111.164 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.737 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.4 p -111.14 -162.15 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.051 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.737 ' H ' HG22 ' A' ' 66' ' ' VAL . 7.2 m-20 -173.03 71.62 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.245 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.453 ' OE2' HG21 ' A' ' 81' ' ' VAL . 49.9 mt-10 -55.73 -22.28 22.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.437 -179.497 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 26.8 t -59.35 -17.48 30.11 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.085 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 62.3 mmtt -64.8 -45.28 86.91 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.794 0.33 . . . . 0.0 111.025 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.3 mptt 61.63 94.08 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.747 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.404 ' CG ' ' HG3' ' A' ' 82' ' ' PRO . 26.2 mmt180 -90.74 165.77 13.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.888 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.8 mttp -125.54 147.4 49.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.129 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -78.35 172.43 13.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.746 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -57.67 -24.0 54.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.227 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 48.8 mp0 -95.1 19.59 10.27 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.28 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.52 9.23 84.62 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.901 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -67.3 -163.5 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.696 0.284 . . . . 0.0 110.799 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -137.95 138.19 38.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.715 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.482 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 1.8 m -140.62 156.32 23.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.221 0.534 . . . . 0.0 111.376 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.477 HG13 ' O ' ' A' ' 81' ' ' VAL . 3.0 p -99.12 98.96 7.16 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 114.993 -1.003 . . . . 0.0 109.916 179.257 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.482 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 96.8 Cg_exo -41.9 145.32 0.77 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.663 2.242 . . . . 0.0 112.853 -178.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.451 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 3.4 mmpt? -94.45 153.12 40.44 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.995 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 19.0 Cg_exo -71.55 141.65 38.67 Favored 'Trans proline' 0 N--CA 1.466 -0.133 0 C-N-CA 123.406 2.737 . . . . 0.0 112.7 -179.01 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -65.55 147.26 53.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.859 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.419 ' HE ' HG23 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -149.63 119.8 7.26 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.668 179.931 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -100.62 156.93 17.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.709 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.8 ttt -133.53 126.82 31.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.237 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.636 ' CE1' HD11 ' A' ' 16' ' ' ILE . 90.2 m-85 -134.22 148.19 50.82 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.518 179.625 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 38.7 t -128.56 133.1 48.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.952 0.406 . . . . 0.0 111.356 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.829 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 0.7 OUTLIER -123.38 160.99 25.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.286 179.679 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 36.1 m-20 -114.3 28.36 8.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.846 0.355 . . . . 0.0 110.876 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.592 ' ND2' HG23 ' A' ' 96' ' ' VAL . 44.9 t-20 -152.7 110.12 3.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.608 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.84 -31.17 37.68 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.016 0.436 . . . . 0.0 110.892 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.61 -54.87 11.91 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.944 179.808 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.592 HG23 ' ND2' ' A' ' 93' ' ' ASN . 50.8 t -58.76 -35.73 57.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.06 0.457 . . . . 0.0 110.332 179.474 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.484 ' HG3' ' CD1' ' A' ' 91' ' ' PHE . 1.7 ttp -66.74 -38.56 86.89 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.641 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.5 ' O ' ' HB3' ' A' ' 102' ' ' MET . 52.0 t0 -69.36 -35.32 75.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.769 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -61.57 -35.64 78.39 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.154 179.562 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.514 HG21 HD22 ' A' ' 60' ' ' LEU . 18.1 mm -71.69 -50.86 36.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.791 179.63 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.485 ' O ' HD21 ' A' ' 48' ' ' LEU . 1.0 OUTLIER -63.24 -27.37 69.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.798 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.5 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.7 OUTLIER -78.51 -41.74 31.52 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.201 179.626 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.603 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -71.92 -40.08 69.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.804 -179.999 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.649 ' HA ' HD12 ' A' ' 107' ' ' ILE . 13.6 mt -61.62 -38.8 88.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.764 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.779 ' HA ' HD12 ' A' ' 108' ' ' ILE . 5.2 mt-30 -63.42 -27.07 69.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.96 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -70.08 -34.07 72.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.124 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.043 HD13 HD13 ' A' ' 42' ' ' LEU . 3.8 mt -74.22 -45.83 46.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.561 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.863 HG22 ' HD3' ' A' ' 112' ' ' LYS . 2.3 mt -56.64 -61.25 1.28 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.542 0 CA-C-O 121.734 0.778 . . . . 0.0 109.5 179.388 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.1 t -49.45 -28.87 5.74 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.783 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 7.2 mtt-85 -67.5 -35.33 78.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.625 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -93.41 -31.88 14.45 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.729 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.863 ' HD3' HG22 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -65.54 -36.69 84.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.523 179.676 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -60.61 -36.91 79.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.924 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.26 -33.41 74.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.087 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 23.0 t70 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.92 179.972 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 63.8 mt . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 120.826 0.346 . . . . 0.0 111.107 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.4 m -131.39 166.81 25.2 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.952 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_exo -51.72 -35.79 59.37 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.598 2.199 . . . . 0.0 112.369 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -54.63 -25.89 29.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.876 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -63.17 -45.34 92.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.801 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 38.0 mm -68.72 -22.44 26.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.309 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -63.68 -32.76 74.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.882 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.73 -30.7 67.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.978 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 53' ' ' TRP . . . . . 0.449 ' CE3' ' CG ' ' A' ' 57' ' ' LYS . 15.2 m95 -53.99 -25.29 20.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.946 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 54' ' ' PHE . . . . . 0.439 ' CZ ' ' HB2' ' A' ' 61' ' ' ARG . 96.2 m-85 -106.86 -22.19 12.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.153 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -81.96 -33.69 30.12 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.877 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -59.97 140.28 56.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.973 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -128.73 163.62 43.94 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.908 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo . . . . . 0 C--O 1.249 1.056 0 C-N-CA 122.643 2.228 . . . . 0.0 112.324 179.92 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo . . . . . 0 N--CA 1.477 0.519 0 CA-C-O 120.873 0.28 . . . . 0.0 111.861 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.3 m -95.14 132.3 40.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.86 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.418 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 25.3 m80 64.37 30.52 13.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.173 0.511 . . . . 0.0 110.999 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.559 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 88.4 p 174.91 126.69 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.634 178.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.419 ' O ' ' C ' ' A' ' 6' ' ' ALA . . . -163.6 110.37 0.42 Allowed Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.868 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.584 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -33.11 116.33 0.23 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.812 0.339 . . . . 0.0 111.261 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.691 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -133.63 151.84 51.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.081 -0.508 . . . . 0.0 112.08 -178.744 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.599 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.0 OUTLIER -97.62 125.12 50.85 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.226 0 CA-C-O 121.062 0.458 . . . . 0.0 110.56 179.203 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.508 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 25.2 t80 -116.65 128.52 55.45 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.912 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.421 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 88.7 mt-10 59.31 33.58 22.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.721 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.7 mttt 75.94 1.87 3.56 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.183 -178.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.501 HG21 ' HE2' ' A' ' 36' ' ' LYS . 35.2 t -101.13 152.07 5.22 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.755 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 178.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.599 ' HA ' HG13 ' A' ' 8' ' ' ILE . 83.4 p -90.65 146.0 24.39 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 121.377 0.608 . . . . 0.0 111.518 -179.384 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.444 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -177.07 -179.17 47.31 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.702 -179.565 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.584 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.4 mm -105.21 136.2 40.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 120.859 0.362 . . . . 0.0 110.285 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.872 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.58 117.89 53.23 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 178.934 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.473 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -124.17 133.73 53.49 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.359 -178.118 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.769 HG23 HD11 ' A' ' 42' ' ' LEU . 82.6 mt -105.8 140.0 25.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.353 -179.031 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -131.36 114.81 15.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.841 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -92.83 5.33 51.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.364 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -78.95 -17.97 54.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.035 0.445 . . . . 0.0 110.383 179.262 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.25 143.48 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.866 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.8 m -117.78 119.66 33.69 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.861 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.433 ' HB3' ' HB3' ' A' ' 43' ' ' SER . 3.4 Cg_exo -78.71 141.1 62.53 Favored 'Cis proline' 0 C--N 1.348 0.548 0 C-N-CA 123.621 -1.408 . . . . 0.0 111.786 -0.151 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -43.59 137.68 2.83 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.01 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.409 ' HA ' ' HG ' ' A' ' 42' ' ' LEU . 72.3 mt-10 -130.24 165.04 23.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.159 0.504 . . . . 0.0 111.835 -179.049 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.872 HD21 HG12 ' A' ' 16' ' ' ILE . 7.0 tt -121.12 125.68 47.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.472 179.099 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.6 m -113.29 128.9 56.62 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.559 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.486 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 58.9 t90 -100.56 126.63 47.03 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.931 178.769 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.46 117.81 25.24 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.653 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 29.7 t -44.42 157.29 0.06 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.882 -179.759 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.444 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.2 OUTLIER -65.18 -39.11 92.44 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.624 0.726 . . . . 0.0 109.146 179.863 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 -85.24 -23.95 28.0 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.629 -1.169 . . . . 0.0 111.017 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 91.28 31.69 9.47 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.615 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -100.0 -19.94 16.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.696 0.284 . . . . 0.0 111.437 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.501 ' HE2' HG21 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -131.62 141.49 49.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.825 0.345 . . . . 0.0 111.092 -179.926 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 13.5 p -139.13 135.02 41.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.27 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.508 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 70.8 t60 -135.07 146.32 48.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.201 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 40.0 m -126.58 140.52 52.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.077 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 93.3 t -134.68 140.93 44.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 121.118 0.485 . . . . 0.0 111.698 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.6 HG22 HG23 ' A' ' 44' ' ' THR . 1.5 p -86.02 118.09 31.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 1.152 HD13 HD13 ' A' ' 107' ' ' ILE . 46.3 mt -74.53 -30.15 61.66 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -178.313 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.433 ' HB3' ' HB3' ' A' ' 24' ' ' PRO . 60.2 p -56.14 -22.06 26.27 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -178.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.6 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -90.82 -24.29 20.34 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.883 0.373 . . . . 0.0 111.331 -179.596 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.955 HD12 ' HB3' ' A' ' 62' ' ' LEU . 42.3 mm -57.78 92.04 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.806 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -80.42 -26.11 38.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.734 -179.343 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.691 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 19.4 mtmt -137.61 152.83 49.79 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.201 0.524 . . . . 0.0 112.049 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.818 HD21 ' HB3' ' A' ' 104' ' ' LEU . 22.2 mt -116.28 124.41 50.11 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.032 179.338 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.406 ' CB ' ' HG3' ' A' ' 61' ' ' ARG . 10.4 mp0 -121.91 130.31 53.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.893 0.378 . . . . 0.0 110.823 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.918 ' HB2' HD12 ' A' ' 60' ' ' LEU . . . -144.66 143.92 30.98 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.965 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.477 HG23 ' O ' ' A' ' 59' ' ' MET . 72.7 p -75.67 123.74 88.52 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.46 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -61.1 154.54 56.57 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.597 2.198 . . . . 0.0 112.537 -179.698 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.17 -42.49 98.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.125 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.6 t -58.07 -27.61 63.8 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.05 0.452 . . . . 0.0 110.831 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.6 t -80.21 119.16 22.6 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.808 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -55.95 -18.65 9.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.521 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.455 ' HD2' ' CD2' ' B' ' 53' ' ' TRP . 5.3 mttm -81.4 126.23 31.36 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.94 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.49 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 28.4 mtp -107.93 117.62 34.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.593 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.477 ' O ' HG23 ' A' ' 51' ' ' THR . 1.7 ttm -174.59 167.97 3.79 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.185 0.517 . . . . 0.0 111.791 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.918 HD12 ' HB2' ' A' ' 50' ' ' ALA . 1.6 tp -153.58 138.97 17.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.918 179.824 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.444 ' HG2' ' CZ ' ' B' ' 54' ' ' PHE . 0.2 OUTLIER -139.98 148.09 41.39 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.005 0.431 . . . . 0.0 111.869 -179.649 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.955 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -109.47 144.34 37.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.582 179.919 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.691 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 2.5 mm -105.82 121.72 58.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.766 0.317 . . . . 0.0 111.112 179.738 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -86.07 131.39 10.48 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.313 179.54 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.4 mttt -46.34 150.63 0.61 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.702 0.287 . . . . 0.0 111.334 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.7 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.3 p -116.86 -162.09 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.973 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.7 ' H ' HG22 ' A' ' 66' ' ' VAL . 25.9 m-20 -166.29 59.8 0.1 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.324 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.616 ' HB3' HG13 ' A' ' 81' ' ' VAL . 86.7 mt-10 -57.44 -21.5 37.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.411 -179.658 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 32.7 t -58.6 -18.23 28.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.116 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -67.56 -51.43 50.77 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.887 0.375 . . . . 0.0 110.956 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.6 mttt 57.65 88.12 0.06 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.033 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.71 135.33 39.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.811 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 18.1 mmtm -75.24 144.84 42.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.313 -179.64 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -95.23 174.15 7.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.87 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -59.6 -19.88 51.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.324 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 49.3 mp0 -87.66 7.69 28.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.434 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.05 18.59 79.24 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.6 -0.81 . . . . 0.0 112.685 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -115.56 145.51 42.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.746 0.307 . . . . 0.0 111.024 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -76.45 146.32 38.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.897 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.441 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 1.3 m -133.7 158.72 42.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.213 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.616 HG13 ' HB3' ' A' ' 68' ' ' GLU . 16.2 t -103.55 98.68 13.21 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.724 178.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.441 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 87.4 Cg_exo -46.13 145.52 5.32 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 122.448 2.099 . . . . 0.0 112.438 -179.157 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.433 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 2.1 mptt -83.45 143.44 44.53 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.056 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 15.1 Cg_exo -73.55 152.56 48.72 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 123.558 2.839 . . . . 0.0 112.629 -178.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -67.2 147.76 52.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.585 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.8 mtp-105 -147.56 120.05 8.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.156 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -99.06 159.05 15.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.402 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 23.1 ttt -133.41 138.94 46.47 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.006 0.431 . . . . 0.0 111.567 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.716 ' CD1' HD11 ' A' ' 16' ' ' ILE . 95.3 m-85 -152.02 125.41 8.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.214 179.643 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.7 t -98.98 133.01 43.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.095 0.474 . . . . 0.0 111.314 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.691 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 80.7 m-85 -120.19 152.71 37.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.629 179.664 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.49 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 16.7 m-20 -108.4 -6.62 16.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.371 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -121.64 108.73 13.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.871 0.367 . . . . 0.0 110.749 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.86 -28.62 3.88 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.112 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -76.28 -54.93 6.06 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.205 -179.694 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 58.9 t -53.42 -47.88 58.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.772 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.411 ' HB3' ' CG ' ' A' ' 91' ' ' PHE . 0.0 OUTLIER -61.4 -35.68 78.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.222 179.473 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 54.5 t0 -64.63 -35.63 81.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.465 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.428 ' O ' ' HB ' ' A' ' 103' ' ' THR . 53.9 m-80 -65.45 -42.93 91.8 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.971 179.228 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.573 HD12 ' CG2' ' A' ' 16' ' ' ILE . 27.4 mm -62.38 -52.15 63.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.573 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.426 ' O ' HD13 ' A' ' 48' ' ' LEU . 6.9 pttp -64.05 -27.87 69.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.657 179.685 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 38.4 mtm -78.84 -40.41 32.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.741 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.451 HG22 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -75.56 -43.52 48.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.016 -179.825 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 1.108 HD21 HD22 ' A' ' 42' ' ' LEU . 3.5 mt -61.43 -33.97 74.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.818 0.342 . . . . 0.0 110.981 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.732 ' HA ' HD12 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -67.85 -26.51 66.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.696 -179.988 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -69.49 -30.1 67.89 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.559 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.152 HD13 HD13 ' A' ' 42' ' ' LEU . 3.9 mt -76.38 -45.37 34.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.244 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.732 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.1 mt -57.87 -61.44 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.63 0 CA-C-O 121.669 0.747 . . . . 0.0 109.516 179.367 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.8 m -51.76 -28.81 16.49 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.284 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 3.9 mtt180 -64.41 -35.35 80.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.524 179.521 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -92.77 -28.86 16.32 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.781 179.81 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.707 ' HD3' HG22 ' A' ' 108' ' ' ILE . 2.0 mptp? -70.53 -39.65 73.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.75 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -63.28 -37.99 89.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.852 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.76 -33.39 75.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.018 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 43.8 t0 . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.192 -0.908 . . . . 0.0 111.237 179.907 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 8.1 tp . . . . . 0 N--CA 1.487 1.418 0 CA-C-O 120.795 0.331 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 2.0 m -134.75 162.3 58.53 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.992 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_exo -51.63 -42.59 55.54 Favored 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 122.6 2.2 . . . . 0.0 112.379 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -57.42 -29.26 63.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.971 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -65.74 -40.49 92.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.888 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.432 ' HA ' ' CD1' ' B' ' 53' ' ' TRP . 31.0 mm -70.7 -24.24 24.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.324 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.05 -34.13 77.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.058 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 52' ' ' GLN . . . . . 0.43 ' HA ' ' HB ' ' B' ' 55' ' ' THR . 0.9 OUTLIER -64.33 -29.77 70.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.192 -179.851 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 53' ' ' TRP . . . . . 0.455 ' CD2' ' HD2' ' A' ' 57' ' ' LYS . 28.7 m95 -54.96 -28.87 54.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.977 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 54' ' ' PHE . . . . . 0.444 ' CZ ' ' HG2' ' A' ' 61' ' ' ARG . 65.3 m-85 -115.55 -13.35 11.55 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.444 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.43 ' HB ' ' HA ' ' B' ' 52' ' ' GLN . 0.8 OUTLIER -84.03 -28.25 27.79 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.677 0.275 . . . . 0.0 110.795 -179.914 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -73.63 115.48 13.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.837 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -148.49 164.51 21.41 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.874 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo . . . . . 0 C--O 1.249 1.051 0 C-N-CA 122.621 2.214 . . . . 0.0 112.355 179.923 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo . . . . . 0 N--CA 1.477 0.526 0 CA-C-O 120.886 0.286 . . . . 0.0 111.831 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.0 m -65.67 -29.08 69.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.07 179.804 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.422 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 66.3 m80 -141.35 34.99 1.67 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.136 0.493 . . . . 0.0 110.963 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.49 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 6.2 p -173.32 116.75 0.27 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.877 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -146.57 117.67 0.97 Allowed Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.391 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.638 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -41.38 108.69 0.1 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.178 0.513 . . . . 0.0 111.673 -179.523 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.66 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -122.35 153.04 39.52 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.974 -178.811 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.546 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -100.11 125.53 53.82 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.236 0 CA-C-O 120.956 0.408 . . . . 0.0 110.35 178.881 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.508 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 5.7 t80 -113.1 130.85 56.04 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.134 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 55.4 34.29 22.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.9 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 30.9 mttm 76.28 1.21 3.37 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.322 -179.046 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.518 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.6 t -99.69 154.29 4.27 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.641 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 178.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.546 ' HA ' HG13 ' A' ' 8' ' ' ILE . 90.6 p -95.65 149.2 21.72 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.579 0.704 . . . . 0.0 112.613 -178.671 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.476 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.42 -179.62 46.53 Favored Glycine 0 N--CA 1.446 -0.648 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.347 -179.797 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.638 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.71 142.65 19.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 117.608 0.704 . . . . 0.0 110.68 179.367 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.836 HG12 HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -106.77 118.49 54.62 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.764 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 179.48 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -118.28 123.91 46.55 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.334 -178.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.422 ' O ' ' HB3' ' A' ' 3' ' ' HIS . 42.2 mt -96.74 138.46 21.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.995 -179.403 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 65.9 m-20 -131.03 114.2 14.89 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.988 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -91.92 5.93 48.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.169 179.626 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -78.95 -18.13 54.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.957 0.408 . . . . 0.0 110.313 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.78 145.24 10.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.886 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.424 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.0 t -119.44 115.65 33.96 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.967 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.454 ' HG2' HG23 ' A' ' 41' ' ' VAL . 79.7 Cg_endo -78.06 146.3 80.54 Favored 'Cis proline' 0 C--N 1.348 0.53 0 C-N-CA 123.42 -1.492 . . . . 0.0 112.193 0.132 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.63 137.69 8.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.629 179.591 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -127.3 167.05 16.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.153 0.501 . . . . 0.0 111.701 -179.152 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.836 HD21 HG12 ' A' ' 16' ' ' ILE . 5.0 tt -121.16 130.58 53.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.8 179.417 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.3 m -116.6 123.93 48.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.117 0.484 . . . . 0.0 111.907 -179.093 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.49 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 58.5 t90 -100.63 128.93 46.51 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.073 179.311 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 8.5 ttm180 -124.68 116.32 22.18 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.824 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.476 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 28.8 t -45.24 164.13 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.091 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.51 -41.42 65.94 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.498 0.666 . . . . 0.0 109.611 179.655 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -81.13 -22.08 39.32 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.075 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.29 33.25 10.75 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.447 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -107.33 -21.12 13.05 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.658 0.266 . . . . 0.0 111.489 -179.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.496 ' NZ ' HG21 ' A' ' 12' ' ' VAL . 7.3 mtmt -127.2 134.41 50.13 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.862 0.363 . . . . 0.0 111.176 -179.852 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.4 t -139.13 136.19 42.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.939 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.508 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 41.5 t-80 -138.81 146.21 41.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.217 0.532 . . . . 0.0 111.387 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 49.6 m -126.09 139.41 53.41 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.893 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 95.8 t -131.77 140.87 47.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.094 0.474 . . . . 0.0 111.637 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.768 HG13 ' CG2' ' A' ' 44' ' ' THR . 1.4 p -85.35 118.06 31.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 178.022 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 1.029 HD13 HD13 ' A' ' 107' ' ' ILE . 61.2 mt -72.38 -30.23 64.49 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.212 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.448 ' CB ' ' HB2' ' A' ' 24' ' ' PRO . 2.3 t -53.91 -23.66 13.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.682 0.277 . . . . 0.0 111.641 -179.516 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.768 ' CG2' HG13 ' A' ' 41' ' ' VAL . 0.2 OUTLIER -84.56 -25.49 28.66 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.137 -179.855 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.622 HD12 ' HB3' ' A' ' 62' ' ' LEU . 45.6 mm -54.33 101.39 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.129 -179.505 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -95.78 -20.66 18.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.54 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.465 ' HB2' HG13 ' A' ' 63' ' ' ILE . 35.8 mttt -153.39 133.43 13.3 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.009 0.433 . . . . 0.0 111.302 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.725 HD11 ' HB3' ' A' ' 104' ' ' LEU . 54.0 mt -105.81 124.28 49.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.632 179.681 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -109.66 130.39 55.52 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.467 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.617 ' HB3' ' HE2' ' A' ' 101' ' ' LYS . . . -142.05 142.07 32.83 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.98 -179.734 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 81.3 p -75.75 137.71 70.09 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.57 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.16 152.95 55.89 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.583 2.189 . . . . 0.0 112.503 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.01 -43.0 99.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.181 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.1 m -58.01 -27.63 63.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.697 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.4 m -82.35 119.99 24.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.795 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -57.2 -18.27 14.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.456 179.155 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.423 ' HB3' ' CE3' ' B' ' 53' ' ' TRP . 32.0 mmtt -58.46 134.49 56.71 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.045 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.467 ' HE3' ' HB3' ' A' ' 58' ' ' MET . 30.5 mmm -122.15 100.56 7.03 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.48 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -174.81 145.15 0.85 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.008 0.432 . . . . 0.0 111.784 -179.659 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.619 HD11 ' HB2' ' A' ' 101' ' ' LYS . 2.5 tt -126.22 131.46 51.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.107 179.388 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.438 ' HB2' ' CZ ' ' B' ' 54' ' ' PHE . 0.0 OUTLIER -112.79 124.05 51.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.96 0.41 . . . . 0.0 111.959 -179.071 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.622 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.4 OUTLIER -92.91 143.53 26.16 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.973 178.753 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.465 HG13 ' HB2' ' A' ' 47' ' ' LYS . 1.1 mm -118.55 120.47 64.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.263 -179.625 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -88.79 147.01 19.57 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.068 179.604 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -59.38 135.35 57.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.9 0.381 . . . . 0.0 111.077 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.487 ' CG2' ' N ' ' A' ' 67' ' ' ASP . 1.8 p -77.88 161.13 4.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.415 0.626 . . . . 0.0 111.563 -179.809 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.487 ' N ' ' CG2' ' A' ' 66' ' ' VAL . 91.2 m-20 -90.77 77.51 6.26 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.627 179.628 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -63.56 -15.98 59.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.377 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 34.0 m -55.26 -21.98 16.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.808 0.337 . . . . 0.0 111.072 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.6 mmtp -78.81 -68.23 0.67 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.864 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.1 mttp 59.86 92.98 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.988 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.422 ' O ' ' N ' ' A' ' 80' ' ' VAL . 20.0 mtm-85 -93.49 -176.95 4.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.414 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -125.82 153.78 43.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.982 0.42 . . . . 0.0 111.165 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -87.03 168.39 13.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.816 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -58.47 -21.05 50.16 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.4 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -90.99 7.53 39.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.614 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.82 -11.91 68.97 Favored Glycine 0 C--N 1.332 0.339 0 C-N-CA 120.511 -0.852 . . . . 0.0 112.755 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -66.72 175.48 2.37 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.74 0.305 . . . . 0.0 110.829 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -96.66 163.76 12.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.924 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.525 HG12 ' N ' ' A' ' 81' ' ' VAL . 22.1 t -135.72 157.78 39.16 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 CA-C-O 121.519 0.676 . . . . 0.0 111.869 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.525 ' N ' HG12 ' A' ' 80' ' ' VAL . 15.6 t -124.73 97.89 38.06 Favored Pre-proline 0 C--N 1.32 -0.715 0 CA-C-N 114.819 -1.082 . . . . 0.0 108.354 177.596 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -45.05 166.24 0.05 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.253 1.969 . . . . 0.0 112.61 -178.302 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.52 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 1.1 mtmm -84.53 137.16 39.08 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 120.934 0.397 . . . . 0.0 110.958 -179.752 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.52 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 10.1 Cg_exo -76.23 165.78 28.87 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 123.367 2.711 . . . . 0.0 112.613 -179.119 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -65.5 156.1 33.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.534 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 66.7 mtm180 -148.68 133.25 17.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.82 0.343 . . . . 0.0 111.154 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.413 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 46.6 m-70 -116.31 159.03 22.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.503 179.554 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.3 ttt -125.69 142.1 51.68 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.996 0.427 . . . . 0.0 111.37 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.558 ' CE2' HD11 ' A' ' 16' ' ' ILE . 95.9 m-85 -152.02 125.81 9.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.514 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.3 t -101.61 143.02 32.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.989 0.423 . . . . 0.0 111.18 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.66 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 54.2 m-85 -130.09 172.48 11.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.671 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 74.8 m-20 -132.36 23.38 4.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.184 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -154.08 116.43 4.34 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.832 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 9.0 mtt85 -57.73 -31.46 66.47 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.001 0.429 . . . . 0.0 110.751 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.03 -54.99 18.99 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.724 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 61.8 t -61.56 -37.55 78.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.186 179.319 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.507 ' HG3' ' CG ' ' A' ' 91' ' ' PHE . 1.4 ttp -69.3 -33.19 72.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.392 179.352 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.467 ' O ' ' HB3' ' A' ' 102' ' ' MET . 22.0 t70 -72.41 -25.13 61.37 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.146 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 23.6 m120 -80.98 -51.59 8.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.977 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 16.8 mm -53.83 -52.07 38.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.027 0.442 . . . . 0.0 110.782 179.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.619 ' HB2' HD11 ' A' ' 60' ' ' LEU . 0.6 OUTLIER -60.59 -27.86 68.04 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.93 179.726 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.467 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.8 OUTLIER -78.78 -43.96 24.3 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.902 -179.972 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.84 -44.31 70.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.087 -179.546 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.78 ' CD2' HD22 ' A' ' 42' ' ' LEU . 16.2 mt -58.33 -38.96 78.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.832 0.349 . . . . 0.0 110.971 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.77 ' HA ' HD12 ' A' ' 108' ' ' ILE . 2.0 mt-30 -63.09 -28.72 70.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.961 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -68.49 -37.21 79.9 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.819 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.029 HD13 HD13 ' A' ' 42' ' ' LEU . 3.4 mt -68.68 -44.55 82.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.335 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.77 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.1 mt -59.96 -61.02 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.618 0 CA-C-O 121.7 0.762 . . . . 0.0 109.319 179.024 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.5 t -50.6 -29.27 10.46 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.392 -1.276 . . . . 0.0 110.903 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 51.1 mtt180 -67.88 -33.81 75.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.079 0.466 . . . . 0.0 110.52 179.548 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -105.47 -0.97 25.45 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.911 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.93 -33.15 7.01 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.839 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -61.79 -36.6 81.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.728 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.12 -33.78 75.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.049 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.846 -179.987 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 45' ' ' LEU . . . . . 0.666 HD21 ' OD2' ' B' ' 49' ' ' ASP . 10.0 tp . . . . . 0 N--CA 1.487 1.413 0 CA-C-O 120.81 0.338 . . . . 0.0 111.097 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.4 m -119.33 163.15 28.46 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.834 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.69 -36.34 92.22 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.604 2.203 . . . . 0.0 112.257 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 50.9 p30 -59.63 -16.83 28.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.037 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 49' ' ' ASP . . . . . 0.666 ' OD2' HD21 ' B' ' 45' ' ' LEU . 2.5 t70 -77.77 -40.27 41.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.267 -179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 32.8 mm -71.65 -29.63 35.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.731 -179.444 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -77.82 -26.24 49.41 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.131 -179.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -59.17 -30.17 67.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.793 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 53' ' ' TRP . . . . . 0.423 ' CE3' ' HB3' ' A' ' 57' ' ' LYS . 14.0 m95 -62.92 -35.28 79.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.871 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 54' ' ' PHE . . . . . 0.438 ' CZ ' ' HB2' ' A' ' 61' ' ' ARG . 82.6 m-85 -99.18 -0.29 41.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.42 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.71 -32.58 74.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.75 0.31 . . . . 0.0 110.855 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -60.03 135.13 57.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.9 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -149.6 85.6 5.67 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.934 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo . . . . . 0 C--O 1.249 1.067 0 C-N-CA 122.622 2.214 . . . . 0.0 112.286 -179.965 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo . . . . . 0 N--CA 1.475 0.424 0 CA-C-O 120.844 0.268 . . . . 0.0 111.787 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.5 t 58.4 107.09 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.027 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 76.2 m80 63.59 33.33 13.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.111 0.482 . . . . 0.0 111.14 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.584 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 64.2 p 178.25 171.83 0.71 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.841 179.139 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 155.78 119.15 0.63 Allowed Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.21 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.628 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -47.07 108.73 0.16 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.101 0.476 . . . . 0.0 111.404 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.814 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -123.7 153.18 41.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.81 -178.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.562 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.9 OUTLIER -99.72 124.36 53.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.976 0.417 . . . . 0.0 110.419 179.021 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.505 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 19.7 t80 -113.19 129.83 56.4 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.085 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.421 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 83.8 mt-10 57.08 34.46 24.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.894 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 29.2 mmtt 75.77 1.93 3.63 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.24 -179.16 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.522 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.9 t -100.78 154.39 4.58 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.634 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.562 ' HA ' HG13 ' A' ' 8' ' ' ILE . 79.9 p -96.67 148.7 22.6 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-O 121.557 0.694 . . . . 0.0 112.517 -178.786 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.484 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.15 -179.74 46.22 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-N 114.649 -1.16 . . . . 0.0 110.404 -179.823 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.628 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.41 141.55 21.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 117.611 0.706 . . . . 0.0 110.602 179.378 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.683 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.75 118.57 54.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 179.53 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.485 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -119.8 139.83 51.72 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.19 -178.667 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.513 ' CG1' HD12 ' A' ' 27' ' ' LEU . 94.1 mt -116.51 140.04 40.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.501 -178.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -125.56 111.37 14.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.7 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -94.21 7.88 43.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.244 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -80.43 -17.91 50.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.814 0.34 . . . . 0.0 110.346 179.362 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.49 ' CG2' ' N ' ' A' ' 23' ' ' SER . 0.6 OUTLIER -106.93 159.27 6.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.201 0.524 . . . . 0.0 111.227 -179.995 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.49 ' N ' ' CG2' ' A' ' 22' ' ' VAL . 7.1 m -131.27 121.54 18.61 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.811 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.431 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 5.7 Cg_exo -76.51 137.58 49.85 Favored 'Cis proline' 0 C--N 1.348 0.504 0 C-N-CA 123.529 -1.446 . . . . 0.0 111.873 -0.063 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.584 ' O ' HD22 ' A' ' 42' ' ' LEU . . . -44.74 140.8 2.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.679 179.614 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -127.36 158.48 37.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.324 0.583 . . . . 0.0 112.046 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.717 ' HB2' HD11 ' A' ' 42' ' ' LEU . 4.2 tt -121.39 129.9 53.3 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.127 179.064 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.0 m -121.05 125.95 48.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.255 0.55 . . . . 0.0 112.334 -178.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.485 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 63.6 t90 -100.6 128.39 46.67 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.647 178.937 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 55.2 ttt-85 -125.59 118.16 25.12 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.863 0.363 . . . . 0.0 111.02 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.484 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 33.3 m -45.63 166.58 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.92 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.02 -41.68 67.26 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.47 0.652 . . . . 0.0 109.754 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -100.37 -9.84 21.83 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.852 -1.067 . . . . 0.0 111.209 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 91.73 26.86 18.68 Favored Glycine 0 C--N 1.331 0.299 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.391 -179.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -71.61 -24.02 61.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.742 0.306 . . . . 0.0 111.673 -179.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.51 153.87 19.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.08 0.467 . . . . 0.0 111.489 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.8 t -139.04 132.81 39.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.699 179.593 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.505 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 15.7 t-80 -133.76 145.9 50.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.195 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.46 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 52.2 m -129.04 140.18 51.72 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.303 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 90.9 t -134.56 141.62 42.87 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.197 0 CA-C-O 121.152 0.501 . . . . 0.0 111.982 179.628 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.73 ' HB ' HG23 ' A' ' 44' ' ' THR . 0.0 OUTLIER -88.36 117.43 31.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.719 177.995 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.767 ' H ' HD22 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -68.3 -19.87 64.72 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 120.784 0.326 . . . . 0.0 110.502 179.464 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 86.0 p -65.03 -28.28 69.38 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.07 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.73 HG23 ' HB ' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -86.71 -26.5 24.21 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.715 179.725 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.884 HD12 ' HB3' ' A' ' 62' ' ' LEU . 45.9 mm -57.24 91.31 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.036 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -60.83 -30.58 70.19 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.035 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.622 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 35.4 mttt -152.36 157.44 41.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.927 0.394 . . . . 0.0 111.21 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.61 HD23 ' HG3' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -131.34 126.03 34.23 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.934 179.456 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -122.24 141.19 51.75 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.01 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.418 ' HB2' HD11 ' A' ' 60' ' ' LEU . . . -136.99 147.86 46.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.046 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.637 HG23 ' O ' ' A' ' 59' ' ' MET . 20.1 p -75.82 124.02 88.48 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.743 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.53 160.62 49.08 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.378 2.052 . . . . 0.0 112.408 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.675 ' HB2' ' HE ' ' A' ' 94' ' ' ARG . . . -58.68 -35.22 72.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.081 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.6 t -58.49 -25.84 62.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.005 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 32.7 t -98.57 115.01 27.68 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.822 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -58.26 -18.41 26.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.693 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.441 ' HE3' ' CG ' ' B' ' 53' ' ' TRP . 4.8 mtmm -71.45 97.37 1.63 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.985 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.501 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 12.0 mmm -82.1 108.27 15.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.765 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.637 ' O ' HG23 ' A' ' 51' ' ' THR . 1.3 tmm? -176.52 145.6 0.57 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.108 0.48 . . . . 0.0 111.742 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.493 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -115.69 159.99 20.65 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.938 179.354 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.441 ' HB2' ' CZ ' ' B' ' 54' ' ' PHE . 7.3 tpt180 -145.86 127.72 15.4 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -179.632 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.884 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -105.56 144.17 32.69 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.316 179.126 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.622 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 2.4 mm -103.65 114.32 42.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.744 0.306 . . . . 0.0 111.416 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -79.32 129.19 8.99 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.106 179.339 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 20.6 mttt -52.03 148.14 6.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.939 0.4 . . . . 0.0 111.197 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.794 HG22 ' H ' ' A' ' 67' ' ' ASP . 2.1 p -108.76 -162.34 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.876 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.794 ' H ' HG22 ' A' ' 66' ' ' VAL . 5.7 t70 -156.7 71.49 0.69 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.97 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.525 ' CG ' HG13 ' A' ' 81' ' ' VAL . 42.0 mp0 -55.67 -21.56 18.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.466 -179.263 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.1 t -56.83 -19.68 18.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.084 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 32.3 mmtt -72.45 -47.67 47.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.978 0.418 . . . . 0.0 110.89 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.2 mmtt 62.85 94.7 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.923 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 15.0 mtt-85 -99.51 143.86 29.27 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.944 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.8 mmtp -87.48 145.66 26.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.005 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.495 ' HB3' HG11 ' A' ' 80' ' ' VAL . 43.6 p30 -97.44 177.6 5.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.107 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -60.99 -19.36 61.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.302 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -88.38 11.41 16.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.516 -179.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 68.67 17.62 71.24 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.708 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -117.09 146.24 43.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.94 0.4 . . . . 0.0 110.876 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -70.71 144.28 51.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.97 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.495 HG11 ' HB3' ' A' ' 74' ' ' ASP . 2.8 m -140.51 158.76 24.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.195 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.525 HG13 ' CG ' ' A' ' 68' ' ' GLU . 18.6 t -83.31 110.37 23.62 Favored Pre-proline 0 C--N 1.327 -0.378 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.429 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.44 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 71.7 Cg_exo -48.58 145.9 11.66 Favored 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 122.094 1.862 . . . . 0.0 112.668 -178.868 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.486 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 29.0 mttm -74.66 102.93 0.74 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.135 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.486 ' HD2' ' HA ' ' A' ' 83' ' ' LYS . 1.0 OUTLIER -40.17 149.38 0.14 Allowed 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 123.534 2.823 . . . . 0.0 112.642 179.275 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.36 155.15 36.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.771 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 55.6 mtt85 -153.49 119.83 5.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.68 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 84.4 m-70 -93.5 154.49 17.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.643 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.532 ' HE3' HG23 ' B' ' 50' ' ' ILE . 24.4 ttt -130.88 118.97 21.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.905 0.383 . . . . 0.0 111.484 -179.639 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.599 ' CE2' HD11 ' A' ' 16' ' ' ILE . 94.4 m-85 -127.73 125.47 40.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.215 179.478 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.98 131.44 44.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.995 0.426 . . . . 0.0 111.211 -179.538 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.814 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 12.1 m-85 -121.08 161.44 21.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.611 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.501 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 75.1 m-20 -124.63 29.34 6.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.009 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 74.8 m-80 -156.6 112.32 2.94 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.795 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.675 ' HE ' ' HB2' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -52.71 -28.17 20.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.05 0.453 . . . . 0.0 111.044 -179.971 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.435 HG22 ' N ' ' A' ' 96' ' ' VAL . 0.9 OUTLIER -77.43 -54.91 5.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.853 179.877 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.435 ' N ' HG22 ' A' ' 95' ' ' THR . 40.3 t -56.31 -44.76 80.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.87 -179.813 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.404 ' CG ' ' HA ' ' A' ' 94' ' ' ARG . 0.2 OUTLIER -65.84 -35.97 82.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.115 179.261 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -66.64 -33.01 74.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.562 179.48 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.437 ' O ' ' HB ' ' A' ' 103' ' ' THR . 76.6 m-20 -63.49 -35.43 80.41 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.874 179.309 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.54 HD12 ' CG2' ' A' ' 16' ' ' ILE . 21.5 mm -71.07 -51.99 30.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.577 179.362 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.593 ' HB2' HD11 ' A' ' 48' ' ' LEU . 11.3 pttp -64.53 -27.23 68.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.614 179.663 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 44.1 mtm -78.21 -38.36 43.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.521 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.458 HG21 HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -78.61 -38.11 40.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.611 179.728 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.643 HD21 HD12 ' A' ' 42' ' ' LEU . 12.0 mt -63.54 -40.36 96.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.592 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.827 ' HA ' HD12 ' A' ' 108' ' ' ILE . 12.1 mt-30 -62.99 -27.4 69.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.979 0.419 . . . . 0.0 111.04 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -70.41 -38.65 74.66 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.151 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.678 HD13 HD23 ' A' ' 42' ' ' LEU . 60.8 mt -68.81 -46.68 79.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.543 -179.654 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.827 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.6 mt -56.61 -60.17 2.22 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.621 0 CA-C-O 121.84 0.828 . . . . 0.0 109.507 179.187 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.7 m -48.78 -29.0 4.05 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.107 -1.406 . . . . 0.0 111.389 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 50.7 mtt-85 -70.82 -32.31 69.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.046 0.45 . . . . 0.0 110.809 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -95.6 -30.85 13.57 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.018 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.802 ' HD3' HG22 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -68.15 -36.87 80.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.577 179.709 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -62.28 -37.99 87.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.924 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.9 -34.55 78.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.06 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 22.8 t70 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.896 -179.945 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 45' ' ' LEU . . . . . 0.536 HD23 ' O ' ' B' ' 45' ' ' LEU . 7.2 tt . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.817 0.341 . . . . 0.0 111.189 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 17.0 p -121.19 164.03 26.45 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.821 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_exo -51.34 -43.25 50.54 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.575 2.184 . . . . 0.0 112.383 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -59.28 -29.05 67.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.815 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -63.86 -45.73 88.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.806 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.532 HG23 ' HE3' ' A' ' 88' ' ' MET . 34.0 mm -67.51 -27.87 40.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.244 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -68.07 -33.31 74.31 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.843 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 52' ' ' GLN . . . . . 0.405 ' HA ' ' HB ' ' B' ' 55' ' ' THR . 0.0 OUTLIER -62.7 -29.95 71.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.09 179.929 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 53' ' ' TRP . . . . . 0.445 ' CE3' ' CE ' ' A' ' 59' ' ' MET . 11.4 m0 -57.72 -29.61 64.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.193 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 54' ' ' PHE . . . . . 0.441 ' CZ ' ' HB2' ' A' ' 61' ' ' ARG . 98.2 m-85 -98.47 -15.63 19.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.554 -179.657 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.405 ' HB ' ' HA ' ' B' ' 52' ' ' GLN . 0.8 OUTLIER -75.41 -30.57 60.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.818 0.342 . . . . 0.0 110.857 -180.0 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 21.3 pt-20 -61.01 139.01 58.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.924 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 62.57 147.86 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.869 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo . . . . . 0 C--O 1.249 1.052 0 C-N-CA 122.511 2.141 . . . . 0.0 112.341 179.934 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo . . . . . 0 N--CA 1.476 0.457 0 CA-C-O 120.92 0.3 . . . . 0.0 111.799 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.3 t -160.58 119.52 2.64 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.727 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.408 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 59.3 m80 65.08 32.94 9.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.077 179.778 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.521 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 60.4 p -175.01 164.58 3.39 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.767 179.239 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.414 ' CA ' HG13 ' A' ' 96' ' ' VAL . . . 160.87 117.93 0.46 Allowed Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.383 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.631 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -47.06 110.46 0.3 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.085 0.469 . . . . 0.0 111.459 -179.695 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.761 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -125.61 150.78 47.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.632 -179.064 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.568 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -99.51 124.99 53.19 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-O 121.014 0.435 . . . . 0.0 110.443 179.332 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.515 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 7.1 t80 -112.93 130.73 56.01 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.163 179.75 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 55.88 34.28 23.25 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.944 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 78.7 mttt 76.11 1.5 3.45 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.274 -179.09 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.53 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.6 t -100.16 154.62 4.36 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.586 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.013 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.568 ' HA ' HG13 ' A' ' 8' ' ' ILE . 89.2 p -96.47 149.15 22.05 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.638 0.733 . . . . 0.0 112.785 -178.487 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.46 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.23 -179.77 46.27 Favored Glycine 0 N--CA 1.445 -0.705 0 CA-C-N 114.436 -1.256 . . . . 0.0 110.298 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.631 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.57 143.39 17.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 117.73 0.765 . . . . 0.0 110.438 179.352 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.887 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.75 118.3 54.22 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.682 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.625 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.486 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -121.64 133.82 54.98 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.345 -178.588 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.622 HG23 HD11 ' A' ' 42' ' ' LEU . 90.6 mt -106.33 140.1 25.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.184 -179.028 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -131.99 111.4 11.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.904 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -89.77 6.26 42.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.312 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -79.02 -18.05 54.25 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.906 0.384 . . . . 0.0 110.398 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -98.98 144.25 12.11 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.09 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.433 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.9 t -116.47 116.32 39.2 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.755 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.447 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 1.8 Cg_endo -80.01 143.8 67.41 Favored 'Cis proline' 0 C--N 1.349 0.562 0 C-N-CA 123.819 -1.326 . . . . 0.0 111.883 -0.05 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.56 140.68 4.19 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.884 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -134.25 167.21 21.12 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.251 0.548 . . . . 0.0 111.746 -179.328 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.887 HD21 HG12 ' A' ' 16' ' ' ILE . 6.0 tt -121.18 128.17 52.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.674 179.572 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.3 m -115.72 128.55 55.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.174 0.511 . . . . 0.0 112.339 -178.603 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.48 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 57.2 t90 -100.53 130.1 46.56 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.461 -0.791 . . . . 0.0 109.714 178.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 17.0 ttt180 -124.45 115.72 21.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.831 0.348 . . . . 0.0 110.947 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.46 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 3.8 p -45.45 166.38 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.109 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.65 -42.0 59.32 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 121.416 0.627 . . . . 0.0 109.792 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 48.7 p30 -81.94 -19.44 40.7 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.313 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.89 33.88 11.89 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.271 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -108.54 -21.37 12.75 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.731 0.271 . . . . 0.0 111.731 -179.698 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.486 ' HE2' HG21 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -128.27 134.52 48.96 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.885 0.374 . . . . 0.0 111.103 -179.793 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 12.2 p -139.3 137.79 40.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.063 179.713 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.515 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 20.3 t-80 -136.97 146.05 44.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.144 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 46.9 m -127.82 134.03 49.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.172 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.7 t -124.33 140.8 46.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.367 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.597 HG22 HG23 ' A' ' 44' ' ' THR . 2.0 p -85.3 117.61 30.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.12 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 1.021 HD13 HD13 ' A' ' 107' ' ' ILE . 83.5 mt -75.38 -29.67 59.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.982 -178.737 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.447 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 10.9 t -55.49 -22.16 19.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.867 -179.2 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.597 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -95.49 -22.14 17.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.719 0.295 . . . . 0.0 111.195 -179.896 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.796 HD12 ' HB3' ' A' ' 62' ' ' LEU . 36.7 mm -57.11 89.3 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.886 -179.795 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -74.32 -27.88 60.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.506 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.724 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 28.6 mtpt -141.13 146.04 36.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.132 0.492 . . . . 0.0 111.769 -179.289 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.694 HD23 ' HG2' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -132.33 124.95 29.8 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.607 179.301 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.664 ' O ' HD23 ' A' ' 60' ' ' LEU . 94.4 mt-30 -127.28 145.05 50.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.943 0.401 . . . . 0.0 111.552 -178.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -133.2 156.98 46.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.836 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 46.5 p -75.74 133.52 73.26 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.528 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.7 154.98 51.24 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.631 2.221 . . . . 0.0 112.557 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.33 -42.98 99.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.155 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.4 m -58.34 -27.53 64.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.09 0.472 . . . . 0.0 110.737 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 29.4 t -81.99 119.85 24.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.811 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -56.84 -18.44 13.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.438 179.199 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.422 ' HD2' ' CE3' ' B' ' 53' ' ' TRP . 24.6 mmtm -61.01 149.38 36.99 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.944 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.404 ' CE ' ' N ' ' A' ' 93' ' ' ASN . 15.6 mmm -133.78 79.98 1.85 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.672 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.423 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.6 OUTLIER -147.62 169.11 20.34 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.06 0.457 . . . . 0.0 112.037 -179.541 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.675 HD21 ' CD1' ' A' ' 48' ' ' LEU . 0.3 OUTLIER -144.69 131.13 19.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.872 179.47 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.469 ' HD2' HD13 ' A' ' 63' ' ' ILE . 4.0 tmm_? -113.48 132.34 55.7 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.043 0.449 . . . . 0.0 112.211 -178.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.796 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -110.48 140.64 44.55 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.229 179.246 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.724 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.2 mm -111.82 127.33 69.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.772 0.32 . . . . 0.0 111.328 179.72 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.56 129.66 9.98 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.217 179.594 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.6 mttt -44.35 145.63 0.79 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.833 0.349 . . . . 0.0 111.413 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.715 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.2 p -117.73 -162.05 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.815 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.715 ' H ' HG22 ' A' ' 66' ' ' VAL . 7.3 t0 -178.81 50.44 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.503 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -57.59 -22.5 45.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.334 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 23.7 t -62.1 -16.11 50.04 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.944 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.1 mttt -69.7 -39.95 76.6 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.094 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.8 mtmt 60.43 90.96 0.06 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.813 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 74.3 mmt-85 -94.4 143.88 26.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.022 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 45.4 mmtt -88.14 145.86 25.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.905 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -94.49 173.21 7.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.894 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -60.33 -20.03 57.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.23 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -86.64 4.79 38.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.426 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.3 15.22 81.73 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.606 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -111.72 144.69 40.6 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.812 0.339 . . . . 0.0 110.99 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -71.76 148.01 46.75 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.044 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.449 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 1.5 m -131.01 158.82 43.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.95 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 38.9 t -103.64 98.58 13.18 Favored Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.749 178.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.449 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 86.8 Cg_exo -46.2 162.61 0.12 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.411 2.074 . . . . 0.0 112.419 -179.106 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.507 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -117.8 143.79 33.19 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.745 179.928 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.507 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 15.2 Cg_exo -73.47 148.29 42.55 Favored 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 123.453 2.768 . . . . 0.0 112.695 -179.087 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -76.61 147.88 37.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.759 179.727 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.8 mtp180 -150.93 121.84 7.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.959 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -110.17 146.99 34.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.627 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -129.61 135.73 48.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.31 -179.723 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.683 ' CE1' HD11 ' A' ' 16' ' ' ILE . 97.7 m-85 -135.6 153.98 51.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.811 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.423 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.4 OUTLIER -126.55 123.89 38.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.912 0.387 . . . . 0.0 110.871 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.761 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 2.2 m-85 -112.87 172.74 6.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.808 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.4 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 23.6 p30 -124.69 26.35 7.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.218 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.404 ' N ' ' CE ' ' A' ' 58' ' ' MET . 80.4 m-20 -158.07 122.02 4.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.97 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -56.91 -35.18 68.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.191 0.519 . . . . 0.0 110.693 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.34 -50.26 60.71 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.014 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.414 HG13 ' CA ' ' A' ' 5' ' ' GLY . 52.4 t -59.48 -39.5 79.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.535 179.567 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.559 ' HG2' HD12 ' A' ' 60' ' ' LEU . 2.0 mtp -65.84 -36.58 83.86 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.525 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -68.96 -34.52 75.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.837 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.43 ' O ' ' HB ' ' A' ' 103' ' ' THR . 11.0 m120 -61.5 -42.65 99.12 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.255 179.58 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.504 HD12 ' CG2' ' A' ' 16' ' ' ILE . 23.9 mm -66.49 -51.44 57.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.543 179.422 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.552 ' HB2' HD11 ' A' ' 48' ' ' LEU . 0.3 OUTLIER -65.52 -27.2 68.29 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.646 179.626 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.1 mmm -78.19 -37.5 45.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.445 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.43 ' HB ' ' O ' ' A' ' 99' ' ' ASN . 0.6 OUTLIER -80.69 -36.8 31.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.666 179.761 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.683 ' HA ' HD12 ' A' ' 107' ' ' ILE . 13.0 mt -63.64 -41.48 98.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.758 179.81 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.76 ' HA ' HD12 ' A' ' 108' ' ' ILE . 1.4 mt-30 -62.42 -28.46 69.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.022 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -69.53 -32.76 71.78 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.035 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.021 HD13 HD13 ' A' ' 42' ' ' LEU . 5.6 mt -75.11 -45.2 42.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.38 -179.675 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.76 HD12 ' HA ' ' A' ' 105' ' ' GLN . 1.9 mt -58.32 -61.13 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.556 0 CA-C-O 121.769 0.795 . . . . 0.0 109.428 179.282 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.4 m -50.72 -28.72 9.69 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.376 -1.284 . . . . 0.0 110.637 179.24 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.3 ttm180 -70.11 -48.31 58.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.263 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.417 ' CE2' ' HA ' ' A' ' 43' ' ' SER . 26.6 m-85 -74.44 -29.09 61.34 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.415 179.66 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 2.2 mttt -63.35 -45.39 91.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.587 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -58.66 -36.6 74.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.937 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.63 -33.06 74.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.137 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 23.3 t70 . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.899 179.98 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 25.0 tp . . . . . 0 N--CA 1.486 1.332 0 CA-C-O 120.908 0.385 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 3.2 m -128.91 164.8 36.39 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.948 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -52.73 -33.74 61.28 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.576 2.184 . . . . 0.0 112.343 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -57.15 -22.75 42.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.039 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -80.82 -36.1 32.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.264 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 42.1 mm -81.54 -29.01 10.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.843 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 19.9 pt-20 -67.0 -28.88 68.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.979 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -60.35 -36.77 78.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.664 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 53' ' ' TRP . . . . . 0.422 ' CE3' ' HD2' ' A' ' 57' ' ' LYS . 44.7 m95 -58.93 -30.74 68.09 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.823 -179.76 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 54' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -99.81 -0.88 38.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.253 179.624 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -105.71 -40.58 5.7 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.85 0.357 . . . . 0.0 110.915 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -59.61 141.14 55.61 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.027 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -142.13 162.32 46.18 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.886 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo . . . . . 0 C--O 1.25 1.082 0 C-N-CA 122.544 2.163 . . . . 0.0 112.322 -179.997 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo . . . . . 0 N--CA 1.476 0.443 0 CA-C-O 120.871 0.28 . . . . 0.0 111.783 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.574 ' HG ' ' CE1' ' A' ' 3' ' ' HIS . 39.9 t -177.87 -72.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.912 -179.838 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.574 ' CE1' ' HG ' ' A' ' 2' ' ' SER . 48.3 m80 -115.05 34.52 4.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.196 0.522 . . . . 0.0 110.93 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.496 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 19.2 p -171.29 141.91 1.65 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.59 179.154 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -172.54 118.19 0.7 Allowed Glycine 0 N--CA 1.446 -0.683 0 C-N-CA 120.531 -0.842 . . . . 0.0 112.429 179.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.642 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -45.68 103.25 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.122 0.487 . . . . 0.0 111.375 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.807 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -119.4 153.78 34.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.813 -178.914 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.649 HG23 ' O ' ' A' ' 12' ' ' VAL . 1.0 OUTLIER -99.98 126.59 53.43 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.255 0 CA-C-O 121.076 0.465 . . . . 0.0 110.372 178.968 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.505 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 22.2 t80 -114.68 128.12 56.14 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.03 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 82.8 mt-10 58.02 37.87 26.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.684 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 10' ' ' GLU . 2.3 mmtt 72.01 2.94 4.5 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.567 -179.153 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.649 ' O ' HG23 ' A' ' 8' ' ' ILE . 39.6 t -101.83 155.19 4.84 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.582 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 178.78 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.554 ' HA ' HG13 ' A' ' 8' ' ' ILE . 96.4 p -96.57 149.07 22.18 Favored 'General case' 0 C--N 1.313 -1.022 0 CA-C-O 121.594 0.712 . . . . 0.0 112.617 -178.557 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.464 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 175.64 -179.59 46.73 Favored Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 114.603 -1.18 . . . . 0.0 110.347 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.642 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.62 141.97 20.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 117.732 0.766 . . . . 0.0 110.53 179.413 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.851 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.68 118.38 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 179.551 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.411 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -119.64 135.0 54.99 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.353 -178.639 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.476 ' CG1' HD12 ' A' ' 27' ' ' LEU . 69.6 mt -107.16 140.12 26.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.597 -0.728 . . . . 0.0 111.171 -179.01 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 70.0 m-20 -132.08 113.25 13.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.925 -179.806 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -90.83 6.11 45.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.169 179.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 86.3 m-20 -79.48 -17.68 53.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.004 0.431 . . . . 0.0 110.478 179.443 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.68 143.77 13.15 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.985 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.436 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.8 t -116.94 116.16 38.21 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.867 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.442 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 2.0 Cg_endo -79.82 144.0 68.92 Favored 'Cis proline' 0 C--N 1.348 0.529 0 C-N-CA 123.782 -1.341 . . . . 0.0 111.954 0.049 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -45.68 140.68 3.27 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.014 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 68.5 mt-10 -133.62 167.11 21.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.247 0.546 . . . . 0.0 111.654 -179.22 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.851 HD21 HG12 ' A' ' 16' ' ' ILE . 4.3 tt -121.18 131.81 54.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.713 179.385 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.4 m -118.32 126.98 53.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.072 0.463 . . . . 0.0 112.093 -178.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.495 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 60.0 t90 -100.52 130.2 46.56 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.974 179.13 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 8.3 ttt85 -125.28 115.8 20.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.799 0.333 . . . . 0.0 110.912 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.464 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 29.5 t -45.49 166.54 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.142 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.07 -42.08 60.74 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.38 0.61 . . . . 0.0 109.663 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 89.7 m-20 -80.07 -22.72 41.94 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.126 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.57 32.96 10.67 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.469 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -108.31 -19.26 13.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.612 0.244 . . . . 0.0 111.471 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.468 ' HE2' HG21 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -127.96 134.95 49.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.791 0.329 . . . . 0.0 111.085 -179.867 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 11.8 p -138.98 139.09 41.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.11 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.505 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 25.9 t-80 -135.82 146.14 47.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.124 0.488 . . . . 0.0 111.253 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 42.0 m -127.52 135.13 49.93 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.846 179.82 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 99.4 t -130.77 140.82 47.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.012 0.434 . . . . 0.0 111.601 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.654 HG22 HG23 ' A' ' 44' ' ' THR . 1.4 p -84.98 117.8 30.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 178.121 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 1.064 HD22 HD21 ' A' ' 104' ' ' LEU . 45.3 mt -75.44 -30.14 59.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.969 -178.622 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.442 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 11.7 t -55.27 -21.7 15.47 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.096 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.654 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -89.37 -22.97 22.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.795 0.331 . . . . 0.0 111.213 -179.7 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.51 HG12 ' HA ' ' A' ' 42' ' ' LEU . 48.3 mm -48.41 106.49 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.953 0.406 . . . . 0.0 111.206 -179.618 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -99.46 -20.09 16.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.404 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.442 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 51.2 mttp -154.53 133.01 11.99 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.961 0.41 . . . . 0.0 111.419 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.723 HD11 ' HB3' ' A' ' 104' ' ' LEU . 87.4 mt -107.7 124.36 49.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.664 179.67 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.492 ' O ' HD23 ' A' ' 60' ' ' LEU . 1.4 tt0 -113.78 134.95 54.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.633 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.608 ' HB1' ' HE1' ' A' ' 97' ' ' MET . . . -142.34 144.99 33.45 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.882 0.372 . . . . 0.0 111.19 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.471 HG22 ' HE2' ' A' ' 57' ' ' LYS . 72.9 p -75.87 129.99 79.72 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.765 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.5 154.31 74.78 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.538 2.159 . . . . 0.0 112.371 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.95 -34.53 74.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.125 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.1 m -59.08 -27.63 65.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.008 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 71.4 m -82.64 120.29 25.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.965 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -58.5 -17.74 23.56 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.525 179.288 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.471 ' HE2' HG22 ' A' ' 51' ' ' THR . 0.0 OUTLIER -84.61 148.2 26.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.184 -179.852 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.409 ' HE2' ' HB3' ' A' ' 58' ' ' MET . 17.5 mmm -119.45 128.35 53.92 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.683 -179.272 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.626 ' HE2' ' CE3' ' B' ' 53' ' ' TRP . 0.6 OUTLIER -179.88 165.25 1.24 Allowed 'General case' 0 N--CA 1.462 0.136 0 CA-C-O 121.251 0.548 . . . . 0.0 112.331 179.771 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.887 HD11 ' HB3' ' A' ' 101' ' ' LYS . 1.2 tt -148.48 137.3 21.6 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.305 -0.862 . . . . 0.0 109.776 179.535 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.433 ' HB2' ' CZ ' ' B' ' 54' ' ' PHE . 0.0 OUTLIER -123.35 126.72 47.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.985 0.421 . . . . 0.0 112.008 -179.186 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.463 HD11 HD22 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -99.74 139.65 35.08 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.015 179.038 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.463 HD13 ' HG2' ' A' ' 86' ' ' ARG . 1.0 OUTLIER -118.67 127.89 75.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.164 -179.761 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -95.78 156.79 21.55 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.237 179.671 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.4 mttp -58.3 157.9 7.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.81 0.338 . . . . 0.0 111.0 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.716 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.2 p -121.86 -162.1 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.966 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.716 ' H ' HG22 ' A' ' 66' ' ' VAL . 54.1 t0 -172.04 61.88 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.278 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.426 ' HB3' HG23 ' A' ' 81' ' ' VAL . 95.1 mt-10 -58.23 -20.79 44.59 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.245 -179.627 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 37.9 m -57.7 -19.08 24.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.087 179.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -61.68 -47.08 86.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.988 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp 62.64 95.31 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.819 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 42.9 mmt180 -103.18 165.44 11.02 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.816 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -125.55 145.3 50.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.979 0.419 . . . . 0.0 111.103 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -85.22 173.01 10.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.872 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.75 -17.76 61.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.291 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -87.65 6.99 31.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.45 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 81.73 -1.35 86.43 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.596 -0.812 . . . . 0.0 112.751 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 25.6 m120 -84.0 159.49 21.21 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.732 0.301 . . . . 0.0 110.765 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -95.95 147.6 23.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.864 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.427 ' CG2' ' N ' ' A' ' 81' ' ' VAL . 0.2 OUTLIER -140.56 152.66 21.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.597 0.713 . . . . 0.0 111.255 -179.997 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.547 HG13 ' O ' ' A' ' 81' ' ' VAL . 5.7 p -103.24 100.1 16.74 Favored Pre-proline 0 C--N 1.32 -0.708 0 CA-C-N 114.487 -1.233 . . . . 0.0 110.634 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -46.8 145.27 6.99 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.409 2.073 . . . . 0.0 112.509 -179.5 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -91.42 151.01 42.28 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.047 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.468 ' HA ' HG23 ' A' ' 66' ' ' VAL . 17.0 Cg_exo -72.49 161.09 45.14 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 123.466 2.777 . . . . 0.0 112.716 -178.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -65.36 138.1 57.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.749 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.463 ' HG2' HD13 ' A' ' 63' ' ' ILE . 6.2 mtp-105 -139.81 119.89 13.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.906 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.412 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 86.2 m-70 -110.22 157.44 19.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.725 179.733 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 3.1 ttt -127.34 140.55 52.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.95 0.405 . . . . 0.0 111.337 -179.663 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.67 ' CE1' HD11 ' A' ' 16' ' ' ILE . 97.9 m-85 -150.69 127.77 11.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.572 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.481 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 14.4 t -107.21 132.48 53.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.906 0.384 . . . . 0.0 111.326 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.807 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 3.4 m-85 -122.29 172.32 8.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.646 179.615 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -128.67 26.21 5.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.966 179.597 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -152.94 119.64 5.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.524 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -55.13 -34.0 63.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.017 0.437 . . . . 0.0 110.937 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.06 -55.29 6.71 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.124 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 48.1 t -60.02 -41.15 85.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.969 0.414 . . . . 0.0 110.198 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.608 ' HE1' ' HB1' ' A' ' 50' ' ' ALA . 0.1 OUTLIER -67.76 -37.15 81.72 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.529 179.632 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.424 ' HA ' ' HG2' ' A' ' 101' ' ' LYS . 84.0 m-20 -76.09 -31.3 58.66 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.967 0.413 . . . . 0.0 111.039 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.421 ' O ' ' HB ' ' A' ' 103' ' ' THR . 94.5 m-20 -59.53 -41.35 89.81 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.379 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.633 HG22 HD12 ' A' ' 104' ' ' LEU . 24.5 mm -65.66 -51.89 57.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.504 179.424 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.887 ' HB3' HD11 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -65.32 -27.13 68.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.476 179.516 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.404 ' N ' ' HG3' ' A' ' 101' ' ' LYS . 43.4 mtm -78.43 -40.28 36.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.708 179.855 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.439 HG22 HD13 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -76.59 -38.83 54.21 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.63 179.846 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 1.064 HD21 HD22 ' A' ' 42' ' ' LEU . 6.5 mt -61.19 -38.98 88.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.572 179.735 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.668 ' HA ' HD12 ' A' ' 108' ' ' ILE . 1.0 OUTLIER -59.0 -32.33 69.61 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.043 0.449 . . . . 0.0 110.427 179.454 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -66.44 -31.24 71.87 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.056 179.087 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.521 HG21 ' CB ' ' A' ' 42' ' ' LEU . 10.0 mm -69.22 -56.7 10.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.579 179.461 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.668 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.2 mt -50.66 -61.08 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.542 0 CA-C-O 121.783 0.801 . . . . 0.0 109.662 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.2 m -51.66 -28.9 15.94 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 114.235 -1.348 . . . . 0.0 110.674 179.313 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.404 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 4.1 mtt-85 -67.33 -40.44 85.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.41 179.483 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.407 ' CZ ' ' HB2' ' A' ' 43' ' ' SER . 86.5 m-85 -84.35 -28.28 27.14 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.382 179.489 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.499 ' CE ' HG22 ' A' ' 108' ' ' ILE . 20.2 mttt -63.08 -43.0 99.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.497 179.258 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -61.06 -36.88 80.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.924 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.29 -33.59 74.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.085 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 52.1 t0 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.274 -0.87 . . . . 0.0 110.842 -179.984 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 27.6 tp . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.741 0.305 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.3 m -123.57 163.74 32.76 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.867 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -55.27 -40.53 85.17 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.646 2.231 . . . . 0.0 112.215 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -55.15 -22.31 16.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.871 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -66.92 -42.92 84.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.783 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 24.9 mm -71.0 -24.19 24.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.361 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -62.38 -38.47 89.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.857 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.06 -33.65 75.88 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.729 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 53' ' ' TRP . . . . . 0.626 ' CE3' ' HE2' ' A' ' 59' ' ' MET . 12.1 m95 -59.4 -34.13 72.07 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.133 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 54' ' ' PHE . . . . . 0.433 ' CZ ' ' HB2' ' A' ' 61' ' ' ARG . 44.0 m-85 -105.65 -3.64 21.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.701 -179.687 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -91.16 -29.91 16.99 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.805 0.336 . . . . 0.0 110.81 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -80.99 144.28 31.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.844 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 58.76 175.0 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.012 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo . . . . . 0 C--O 1.249 1.027 0 C-N-CA 122.563 2.175 . . . . 0.0 112.305 -179.942 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.3 m . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.799 0.333 . . . . 0.0 110.873 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 35.4 m80 63.29 33.58 13.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.287 0.565 . . . . 0.0 111.08 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.529 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 54.9 p 177.59 129.28 0.05 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.637 179.189 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -164.04 114.47 0.6 Allowed Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.598 -0.811 . . . . 0.0 112.335 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.642 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -43.7 100.57 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.165 0.507 . . . . 0.0 111.436 -179.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.821 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -116.54 154.71 29.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.909 -178.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.685 HG23 ' O ' ' A' ' 12' ' ' VAL . 1.0 OUTLIER -101.78 126.63 55.69 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 CA-C-O 121.105 0.479 . . . . 0.0 110.443 178.967 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.499 ' CD1' ' CE2' ' A' ' 89' ' ' PHE . 15.4 t80 -114.0 130.67 56.53 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.208 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.427 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 37.4 mt-10 55.73 35.08 24.63 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.024 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 28.2 mttm 76.24 1.28 3.39 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.394 -179.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.685 ' O ' HG23 ' A' ' 8' ' ' ILE . 42.1 t -99.6 156.68 3.94 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.644 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 178.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.554 ' HA ' HG13 ' A' ' 8' ' ' ILE . 91.1 p -98.86 149.68 22.66 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-O 121.435 0.636 . . . . 0.0 112.408 -178.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.476 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 174.53 -179.53 45.79 Favored Glycine 0 N--CA 1.447 -0.624 0 N-CA-C 110.281 -1.128 . . . . 0.0 110.281 -179.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.642 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.45 142.49 19.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 117.719 0.76 . . . . 0.0 110.493 179.368 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.836 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.63 118.29 54.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 179.784 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -120.19 136.83 54.5 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.17 0.51 . . . . 0.0 111.533 -178.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.695 HG23 HD11 ' A' ' 42' ' ' LEU . 88.5 mt -109.95 140.03 30.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.095 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.8 t-20 -131.29 111.56 11.99 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.915 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -91.54 6.64 44.85 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.275 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 50.8 t0 -79.56 -17.99 52.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.921 0.391 . . . . 0.0 110.333 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -102.78 144.17 14.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.903 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.438 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 70.3 m -116.15 118.89 37.5 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.969 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.438 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 1.8 Cg_endo -80.84 137.88 40.98 Favored 'Cis proline' 0 C--N 1.348 0.519 0 C-N-CA 123.768 -1.347 . . . . 0.0 111.891 -0.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -42.95 140.61 1.33 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.068 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -132.46 167.06 20.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.213 0.53 . . . . 0.0 111.81 -179.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.836 HD21 HG12 ' A' ' 16' ' ' ILE . 5.2 tt -121.11 131.18 54.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.788 179.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 45.2 m -118.75 126.27 51.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.062 0.458 . . . . 0.0 112.047 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.493 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 62.2 t90 -100.43 128.14 46.57 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.814 178.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.452 ' HG2' HG22 ' A' ' 37' ' ' VAL . 0.0 OUTLIER -125.02 118.8 27.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.841 0.353 . . . . 0.0 111.062 -179.843 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.441 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 30.7 t -45.44 167.18 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.314 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.3 -42.78 53.95 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.491 0.662 . . . . 0.0 109.748 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -85.22 -17.83 35.88 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.91 -1.041 . . . . 0.0 111.109 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.74 33.9 12.25 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.359 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -98.83 -22.08 16.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.625 0.25 . . . . 0.0 111.568 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.12 144.11 40.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.989 0.423 . . . . 0.0 111.379 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.452 HG22 ' HG2' ' A' ' 30' ' ' ARG . 42.4 t -139.23 144.06 29.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.758 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.493 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 49.3 t60 -137.27 145.95 44.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.03 0.443 . . . . 0.0 111.415 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.2 m -128.77 137.87 51.78 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.797 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 88.5 t -135.98 140.86 43.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.997 0.427 . . . . 0.0 111.663 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.653 HG22 HG23 ' A' ' 44' ' ' THR . 1.7 p -83.25 117.36 28.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 177.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.941 HD13 HD13 ' A' ' 107' ' ' ILE . 85.8 mt -75.63 -34.27 60.55 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.162 -0.472 . . . . 0.0 112.187 -178.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.422 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 22.4 t -51.07 -24.62 4.07 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.031 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.653 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -85.81 -23.7 27.09 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.816 0.341 . . . . 0.0 111.142 -179.693 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.537 HG12 ' HA ' ' A' ' 42' ' ' LEU . 41.9 mm -47.27 101.5 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.314 -179.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.402 ' N ' ' O ' ' A' ' 63' ' ' ILE . 11.2 t70 -95.25 -20.7 18.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.444 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.523 ' HB2' HG13 ' A' ' 63' ' ' ILE . 46.1 mtmt -153.33 138.58 17.47 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.939 0.399 . . . . 0.0 111.286 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.612 HD21 ' HB3' ' A' ' 104' ' ' LEU . 34.1 mt -109.59 124.35 50.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.899 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.401 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 25.9 mt-30 -109.91 130.48 55.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.398 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.662 ' HB3' ' HE2' ' A' ' 101' ' ' LYS . . . -145.81 138.95 26.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.097 -179.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 70.0 p -75.76 133.66 73.03 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.549 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.39 149.94 78.2 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.593 2.196 . . . . 0.0 112.443 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.02 -41.68 97.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.142 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 87.3 p -59.29 -26.17 64.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.867 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.9 t -87.73 118.91 27.55 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.874 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -57.7 -18.45 20.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.389 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 30.3 mmtt -65.51 110.07 2.57 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.995 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.464 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 19.0 mmm -94.49 123.9 38.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.44 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 11.5 ttm -177.18 160.42 1.73 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.224 0.535 . . . . 0.0 111.994 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.3 tp -148.46 123.91 10.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.86 179.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.401 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 33.0 mtt180 -116.47 136.68 52.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.141 0.496 . . . . 0.0 112.039 -178.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.424 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -111.55 131.0 55.55 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.884 179.02 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.523 HG13 ' HB2' ' A' ' 47' ' ' LYS . 1.0 OUTLIER -109.07 122.14 63.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.128 -179.365 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.58 145.96 17.89 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.354 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.9 mttt -58.62 158.82 7.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.854 0.359 . . . . 0.0 110.959 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.69 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.1 p -121.55 -162.13 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.894 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.69 ' H ' HG22 ' A' ' 66' ' ' VAL . 5.3 m-20 -175.99 55.41 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.33 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -58.3 -21.55 49.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.279 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 35.6 m -59.58 -17.96 37.06 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.061 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -69.05 -38.75 79.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.043 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.3 mptt 59.62 92.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.819 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.423 ' O ' HG22 ' A' ' 80' ' ' VAL . 43.0 mmt180 -95.2 140.87 29.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.991 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 26.1 mmtp -87.6 145.64 26.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.986 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -93.43 172.51 8.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.887 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -60.07 -19.98 55.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.328 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 51.2 mp0 -86.41 4.63 38.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.422 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.62 14.36 82.52 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.699 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -110.45 144.73 38.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.912 0.387 . . . . 0.0 110.948 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -70.96 148.97 47.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.105 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.462 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.1 m -132.21 158.83 43.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.932 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.5 t -102.66 98.62 11.43 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.671 178.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.462 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 85.0 Cg_exo -45.61 161.66 0.12 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.428 2.085 . . . . 0.0 112.546 -179.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -115.0 150.47 44.25 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.054 0.454 . . . . 0.0 110.978 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -72.56 147.41 45.87 Favored 'Trans proline' 0 N--CA 1.465 -0.164 0 C-N-CA 123.466 2.777 . . . . 0.0 112.728 -179.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -72.5 142.36 48.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.796 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.403 ' HG2' HG23 ' A' ' 63' ' ' ILE . 87.0 mtt180 -150.68 119.95 6.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.853 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -105.7 159.06 16.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.671 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.0 ttt -131.74 121.43 24.2 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.929 0.395 . . . . 0.0 111.33 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.646 ' CE2' HD11 ' A' ' 16' ' ' ILE . 91.8 m-85 -128.67 154.0 46.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.505 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 33.1 t -126.68 134.13 50.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.951 0.405 . . . . 0.0 111.141 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.821 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 83.3 m-85 -120.37 162.07 20.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.48 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.464 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 8.9 m120 -109.43 -21.28 12.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.214 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.566 ' HB2' HG23 ' A' ' 96' ' ' VAL . 87.0 m-20 -116.51 112.6 21.61 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.658 179.753 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -48.06 -29.38 3.5 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.02 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.5 -48.92 63.16 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.119 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.566 HG23 ' HB2' ' A' ' 93' ' ' ASN . 52.6 t -58.79 -52.73 56.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.416 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.482 ' HB3' ' CG ' ' A' ' 91' ' ' PHE . 4.0 ptm -62.91 -32.11 73.32 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.464 ' O ' ' HB3' ' A' ' 102' ' ' MET . 12.0 m-20 -63.63 -34.2 77.32 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.182 179.284 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -72.05 -44.18 63.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.483 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.501 HD12 ' CG2' ' A' ' 16' ' ' ILE . 23.4 mm -60.14 -50.52 79.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.568 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.662 ' HE2' ' HB3' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -61.7 -30.92 71.06 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.939 179.855 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.464 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.1 OUTLIER -79.09 -43.72 23.55 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.506 179.83 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.497 HG21 HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -67.47 -42.69 82.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.849 -179.801 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.818 ' CD2' HD22 ' A' ' 42' ' ' LEU . 35.9 mt -61.7 -39.49 91.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.556 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.519 ' HA ' HD12 ' A' ' 108' ' ' ILE . 36.5 mt-30 -60.86 -32.26 71.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.686 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -68.56 -29.48 68.05 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.812 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.941 HD13 HD13 ' A' ' 42' ' ' LEU . 23.4 mt -77.25 -50.44 20.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.319 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.519 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.3 mt -56.58 -61.1 1.32 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.622 0 CA-C-O 121.749 0.785 . . . . 0.0 109.268 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.6 t -50.56 -28.83 9.37 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.394 -1.275 . . . . 0.0 110.574 179.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 2.2 mtt180 -65.66 -39.83 91.8 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.663 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -85.9 -30.05 23.16 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.592 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.453 ' HE3' HG22 ' A' ' 108' ' ' ILE . 1.6 mttt . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.465 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.0 m . . . . . 0 C--O 1.233 0.193 0 CA-C-O 120.843 0.354 . . . . 0.0 110.972 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.416 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 58.8 m80 -134.93 35.46 3.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.169 0.509 . . . . 0.0 110.927 -179.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.537 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 58.7 p -178.61 114.96 0.07 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.919 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.424 ' O ' ' C ' ' A' ' 6' ' ' ALA . . . -146.2 113.24 0.67 Allowed Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.946 -0.645 . . . . 0.0 111.978 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.549 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -32.71 121.13 0.34 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.741 0.305 . . . . 0.0 111.327 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.716 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -137.35 149.96 47.38 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -178.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.597 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.2 mp -98.14 124.31 51.14 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.306 0 CA-C-O 121.119 0.485 . . . . 0.0 110.408 179.189 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.502 ' CD1' ' CE2' ' A' ' 89' ' ' PHE . 14.7 t80 -115.85 130.6 56.9 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.069 179.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 58.27 33.71 23.4 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.824 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.1 mttm 75.64 1.34 3.57 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.084 -178.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.485 ' O ' HG23 ' A' ' 8' ' ' ILE . 31.3 t -100.8 149.76 6.04 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.728 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.597 ' HA ' HG13 ' A' ' 8' ' ' ILE . 66.7 p -88.25 145.94 25.6 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.548 -179.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.449 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -175.54 -179.24 45.95 Favored Glycine 0 N--CA 1.442 -0.93 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.668 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.549 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 8.0 mm -106.69 136.32 41.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 CA-C-O 120.792 0.329 . . . . 0.0 110.138 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.652 HG12 HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -106.63 117.81 53.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 178.939 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.483 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -124.18 125.5 44.55 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.239 0.542 . . . . 0.0 111.551 -178.076 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.439 ' CD1' HG22 ' A' ' 103' ' ' THR . 33.7 mt -94.55 139.97 17.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.809 -179.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -131.41 113.76 14.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.031 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -91.01 5.47 48.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.239 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -78.59 -17.96 55.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.937 0.399 . . . . 0.0 110.428 179.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.33 143.96 12.7 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.824 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.422 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 1.4 t -119.61 116.15 33.44 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.966 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.483 ' HB2' ' CB ' ' A' ' 43' ' ' SER . 72.1 Cg_endo -77.39 148.41 87.08 Favored 'Cis proline' 0 C--N 1.348 0.544 0 C-N-CA 123.258 -1.559 . . . . 0.0 112.29 -0.098 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.56 139.37 7.02 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.793 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -130.66 166.98 19.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.192 0.52 . . . . 0.0 111.577 -179.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.652 HD21 HG12 ' A' ' 16' ' ' ILE . 4.8 tt -121.16 128.61 52.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.824 179.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.7 m -116.08 127.2 54.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.065 0.46 . . . . 0.0 111.821 -179.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.496 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 55.3 t90 -100.45 125.15 46.71 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.108 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.834 ' HD2' HG22 ' A' ' 37' ' ' VAL . 14.6 tpt180 -120.92 116.65 25.53 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.589 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 26.3 t -44.54 156.8 0.07 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.675 0.274 . . . . 0.0 110.879 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.449 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -65.94 -39.42 90.48 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 121.586 0.708 . . . . 0.0 109.305 179.866 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -88.16 -20.01 26.18 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.603 -1.18 . . . . 0.0 111.091 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.58 33.48 11.41 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.483 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -97.59 -22.31 16.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.704 0.288 . . . . 0.0 111.525 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.94 145.01 43.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.208 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.834 HG22 ' HD2' ' A' ' 30' ' ' ARG . 38.8 t -139.14 140.0 38.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.185 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.502 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 45.9 t60 -139.61 145.84 39.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.401 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 52.4 m -129.02 138.44 51.92 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.97 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 85.4 t -132.61 140.91 46.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 121.151 0.5 . . . . 0.0 111.846 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.566 HG22 HG23 ' A' ' 44' ' ' THR . 2.1 p -87.42 118.12 32.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.166 178.027 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.994 HD13 HD13 ' A' ' 107' ' ' ILE . 84.3 mt -74.92 -31.77 61.63 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -178.305 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.483 ' CB ' ' HB2' ' A' ' 24' ' ' PRO . 3.2 t -53.74 -24.66 15.62 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.566 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -92.0 -22.41 19.99 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.806 0.336 . . . . 0.0 111.13 -179.791 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.567 HD12 ' HB3' ' A' ' 62' ' ' LEU . 46.4 mm -56.2 91.91 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.11 0.481 . . . . 0.0 110.844 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -63.36 -29.55 70.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.394 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.635 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 0.3 OUTLIER -153.99 157.41 39.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.09 0.471 . . . . 0.0 111.587 -179.751 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.632 HD23 ' HG3' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -128.34 127.59 42.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.544 179.138 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.766 ' O ' HD23 ' A' ' 60' ' ' LEU . 96.7 mt-30 -115.99 141.27 48.34 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.006 0.432 . . . . 0.0 111.548 -179.102 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.497 ' HB2' HD21 ' A' ' 60' ' ' LEU . . . -148.12 135.36 20.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.699 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 68.7 p -75.79 131.49 76.48 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.823 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -69.25 160.66 48.97 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.527 2.152 . . . . 0.0 112.404 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.9 -40.56 73.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.159 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 86.0 p -62.75 -26.79 68.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.816 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 41.2 t -75.74 121.7 22.92 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.92 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -56.25 -18.69 11.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.273 179.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.04 154.48 35.65 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.717 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.461 ' HE2' ' O ' ' A' ' 91' ' ' PHE . 63.6 mtp -143.07 79.75 1.66 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.916 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.4 mpp? -155.24 169.1 24.97 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.049 0.452 . . . . 0.0 111.446 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.766 HD23 ' O ' ' A' ' 49' ' ' GLN . 0.2 OUTLIER -132.36 124.24 28.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.989 179.33 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.415 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 2.6 mmt180 -107.83 121.95 45.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.954 0.407 . . . . 0.0 111.846 -179.051 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.567 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -102.7 134.8 45.49 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.141 178.968 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.635 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.3 mm -99.95 150.13 5.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.532 -0.303 . . . . 0.0 111.069 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -115.62 134.28 11.42 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.206 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 25.7 mttt -53.78 139.52 32.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.852 0.358 . . . . 0.0 111.066 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.74 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.4 p -113.3 -161.92 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.956 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.74 ' H ' HG22 ' A' ' 66' ' ' VAL . 0.2 OUTLIER -176.97 67.79 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.141 179.923 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.633 ' OE2' HG11 ' A' ' 66' ' ' VAL . 50.8 mp0 -58.31 -20.87 46.46 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.426 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 27.0 t -58.97 -17.98 29.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.176 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 52.7 mmtt -62.41 -44.02 97.43 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.777 0.323 . . . . 0.0 111.142 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 60.38 92.99 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.774 -179.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 14.1 mtt-85 -106.55 150.6 25.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.989 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.9 mmtt -96.64 149.05 22.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.91 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -96.58 171.66 8.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.866 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -59.68 -20.19 54.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.283 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -86.76 5.96 33.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.389 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.12 15.92 81.06 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.573 -0.823 . . . . 0.0 112.638 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -111.91 145.26 39.85 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.9 0.381 . . . . 0.0 110.943 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -74.04 145.74 44.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.942 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.478 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.2 m -130.53 158.92 42.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.062 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 19.0 t -101.62 98.66 9.9 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.698 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.478 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 80.8 Cg_exo -44.59 145.41 2.69 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.369 2.046 . . . . 0.0 112.651 -179.083 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.449 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 13.1 mtmt -100.67 148.54 35.14 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.953 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 16.8 Cg_exo -72.41 150.52 52.34 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 123.425 2.75 . . . . 0.0 112.654 -178.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -70.89 153.93 42.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.839 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.6 mpp_? -156.5 119.99 4.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.844 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 62.1 m-70 -100.61 155.76 17.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.575 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 23.9 ttt -129.13 125.23 36.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.903 0.382 . . . . 0.0 111.249 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.502 ' CE2' ' CD1' ' A' ' 9' ' ' PHE . 91.9 m-85 -130.86 146.38 52.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.484 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 5.8 t -119.39 133.64 55.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.867 0.365 . . . . 0.0 110.983 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.716 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 2.5 m-85 -125.96 136.35 52.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.82 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 34.2 m-20 -97.1 22.2 8.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.791 0.329 . . . . 0.0 111.076 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -144.99 107.28 4.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.573 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -52.83 -28.82 24.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.071 0.463 . . . . 0.0 111.055 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -77.16 -54.9 5.93 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.303 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 53.4 t -53.87 -46.97 64.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.856 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.66 -35.6 80.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.29 179.514 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -65.86 -32.79 74.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.559 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -66.71 -41.05 88.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.117 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.553 HD12 ' CG2' ' A' ' 16' ' ' ILE . 22.6 mm -66.29 -48.75 80.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.518 179.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.601 ' HB2' HD11 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -66.56 -27.63 67.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.57 179.664 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 40.6 mtm -78.48 -39.08 39.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.616 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.439 HG22 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -80.62 -32.03 36.44 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.658 179.841 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.753 ' HA ' HD12 ' A' ' 107' ' ' ILE . 13.6 mt -65.99 -39.33 90.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.621 179.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.816 ' HA ' HD12 ' A' ' 108' ' ' ILE . 10.6 mt-30 -62.71 -26.83 68.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.883 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -70.33 -43.73 69.69 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.951 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.994 HD13 HD13 ' A' ' 42' ' ' LEU . 4.1 mt -61.86 -47.02 95.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.327 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.911 HG22 ' CD ' ' A' ' 112' ' ' LYS . 2.6 mt -57.43 -60.03 2.58 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.572 0 CA-C-O 121.838 0.828 . . . . 0.0 109.347 179.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.1 m -48.78 -28.92 3.99 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.088 -1.414 . . . . 0.0 111.266 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.47 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 35.3 mtt-85 -69.26 -32.54 71.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.044 0.45 . . . . 0.0 110.809 179.686 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -90.01 -28.8 18.85 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.926 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.911 ' CD ' HG22 ' A' ' 108' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.336 0 CA-C-O 120.881 0.372 . . . . 0.0 110.543 179.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.2 t . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.851 0.358 . . . . 0.0 111.049 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 61.4 m80 64.42 32.5 11.89 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.172 0.511 . . . . 0.0 110.989 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.557 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 77.4 p 177.6 161.73 0.52 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.594 179.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.522 ' CA ' HG13 ' A' ' 96' ' ' VAL . . . 162.78 116.19 0.37 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.296 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.65 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -46.64 103.6 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.192 0.52 . . . . 0.0 111.431 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.833 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -118.87 152.23 36.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.769 -178.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.641 HG23 ' O ' ' A' ' 12' ' ' VAL . 1.0 OUTLIER -99.55 125.25 53.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.072 0.463 . . . . 0.0 110.419 179.009 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.507 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 10.0 t80 -113.34 130.12 56.36 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.132 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 82.5 mt-10 56.85 34.77 25.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.933 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.2 mttm 76.02 1.2 3.44 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.406 -179.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.641 ' O ' HG23 ' A' ' 8' ' ' ILE . 41.5 t -100.31 156.18 4.19 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.617 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.57 ' HA ' HG13 ' A' ' 8' ' ' ILE . 94.1 p -98.19 149.0 23.02 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 121.427 0.632 . . . . 0.0 112.588 -178.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.476 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.16 -179.74 46.24 Favored Glycine 0 N--CA 1.449 -0.493 0 CA-C-N 114.653 -1.158 . . . . 0.0 110.313 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.65 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.59 141.54 21.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 117.615 0.707 . . . . 0.0 110.406 179.344 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.846 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.63 118.45 54.37 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.737 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 179.565 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.486 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -120.99 131.19 54.15 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.17 0.51 . . . . 0.0 111.546 -178.467 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.77 HG23 HD11 ' A' ' 42' ' ' LEU . 90.3 mt -106.08 138.57 30.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.056 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -131.32 117.18 18.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.149 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -93.63 4.93 53.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.189 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -79.12 -17.59 54.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.959 0.409 . . . . 0.0 110.318 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.22 141.22 17.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.873 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.484 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.0 t -114.28 116.33 44.33 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.825 179.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.484 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 1.2 Cg_endo -81.43 142.95 56.86 Favored 'Cis proline' 0 C--N 1.349 0.589 0 C-N-CA 123.807 -1.33 . . . . 0.0 111.934 0.102 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -45.33 141.64 2.47 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.142 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -136.59 167.15 21.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.158 0.504 . . . . 0.0 111.626 -179.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.846 HD21 HG12 ' A' ' 16' ' ' ILE . 5.1 tt -121.19 129.2 53.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.818 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.7 m -117.43 126.21 52.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.159 0.504 . . . . 0.0 112.177 -178.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.479 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 59.8 t90 -100.51 128.88 46.44 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.937 179.008 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 26.3 ttt180 -124.58 116.78 22.99 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.81 0.338 . . . . 0.0 111.069 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.476 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 16.3 m -46.11 168.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.125 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -42.07 61.72 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 121.48 0.657 . . . . 0.0 109.555 179.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -85.22 -20.19 30.52 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.832 -1.076 . . . . 0.0 111.03 179.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.01 33.26 11.09 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.513 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 51.9 t0 -100.55 -23.1 14.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.655 0.264 . . . . 0.0 111.425 -179.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.427 ' CE ' HG21 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -129.88 135.67 48.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.995 -179.947 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 12.7 p -139.12 130.32 34.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.143 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.507 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 51.3 t60 -129.43 145.79 51.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.022 0.439 . . . . 0.0 111.291 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 46.1 m -129.07 135.05 48.39 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.965 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 98.7 t -126.26 140.87 47.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.161 0.505 . . . . 0.0 111.513 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.577 HG22 HG23 ' A' ' 44' ' ' THR . 2.1 p -85.51 117.55 30.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 1.058 HD13 HD13 ' A' ' 107' ' ' ILE . 72.5 mt -75.37 -29.66 59.96 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.995 -178.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.448 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 9.7 t -56.14 -21.71 24.22 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.225 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.577 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -96.8 -21.89 17.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.699 0.285 . . . . 0.0 111.186 -179.794 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.761 HD12 ' HB3' ' A' ' 62' ' ' LEU . 38.0 mm -56.64 90.59 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.049 0.452 . . . . 0.0 110.89 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -71.06 -27.25 63.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.604 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.74 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 20.7 mttm -144.74 152.39 40.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.013 0.435 . . . . 0.0 111.629 -179.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.621 HD23 ' HG2' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -132.69 131.13 40.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.988 179.345 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.403 ' O ' HD23 ' A' ' 60' ' ' LEU . 94.1 mt-30 -125.9 143.78 50.94 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.95 -179.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.603 ' HB1' ' CE ' ' A' ' 97' ' ' MET . . . -145.26 145.94 31.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.979 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 42.5 p -75.7 128.26 84.06 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.505 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -61.41 154.16 60.91 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.573 2.182 . . . . 0.0 112.467 -179.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.87 -40.51 97.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.173 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 85.3 p -59.44 -26.8 65.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.859 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 29.5 m -86.32 117.37 25.08 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.843 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -56.38 -18.65 11.67 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.596 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.8 mmtm -71.83 124.0 23.88 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.029 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 27.3 mmm -104.15 118.9 37.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.498 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.4 ttm -175.75 161.62 2.58 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.176 0.512 . . . . 0.0 112.006 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.403 HD23 ' O ' ' A' ' 49' ' ' GLN . 1.4 tt -153.59 123.94 7.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.756 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 29.8 ttp180 -117.94 138.03 52.44 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.761 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -112.44 136.17 52.26 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.259 179.291 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.74 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.3 mm -103.29 133.79 46.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.816 0.341 . . . . 0.0 111.142 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -101.93 134.07 11.61 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.076 179.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 40.1 mttt -44.1 137.5 3.35 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.942 0.401 . . . . 0.0 111.286 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.722 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.2 p -105.2 -162.13 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.009 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.722 ' H ' HG22 ' A' ' 66' ' ' VAL . 52.1 t0 -173.55 68.99 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.261 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -56.0 -22.21 25.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.398 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.4 m -58.2 -18.87 29.04 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.907 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.7 mtmt -69.57 -42.62 74.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.981 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.7 mttt 60.26 92.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.866 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -92.03 137.9 31.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.873 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 28.8 mmtm -89.16 145.29 25.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.897 0.38 . . . . 0.0 110.893 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -93.29 171.95 8.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.883 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 40.7 t-20 -59.43 -20.53 55.74 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.301 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 50.7 mp0 -86.41 3.44 43.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.359 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.07 14.29 82.05 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.709 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -110.08 144.43 38.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.909 0.385 . . . . 0.0 110.969 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -70.73 147.26 49.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.094 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.432 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.8 m -140.48 158.65 24.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.028 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 20.3 t -83.64 110.19 23.23 Favored Pre-proline 0 C--N 1.326 -0.444 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.432 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 86.1 Cg_exo -46.2 145.26 5.7 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.196 1.931 . . . . 0.0 112.622 -178.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.519 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 8.5 mmtm -83.09 99.3 0.64 Allowed Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.126 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.519 ' HD2' ' HA ' ' A' ' 83' ' ' LYS . 1.3 Cg_endo -40.77 149.61 0.16 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 123.433 2.755 . . . . 0.0 112.598 179.165 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -65.38 139.64 58.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.776 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 12.0 mtp180 -150.5 120.02 6.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.868 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -103.48 143.49 32.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.579 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 23.7 ttt -118.55 131.91 56.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.231 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.57 ' CE1' HD11 ' A' ' 16' ' ' ILE . 94.1 m-85 -139.2 144.39 38.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.645 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 1.5 m -125.17 135.1 52.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.074 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.833 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 2.1 m-85 -123.22 172.5 8.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.532 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 69.9 m-20 -126.74 26.9 6.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.005 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -157.3 121.77 4.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.607 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 32.9 mmt-85 -56.1 -36.18 67.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.026 0.441 . . . . 0.0 110.76 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.14 -55.17 15.32 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.919 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.522 HG13 ' CA ' ' A' ' 5' ' ' GLY . 55.3 t -61.13 -40.75 86.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.105 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.603 ' CE ' ' HB1' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -69.31 -34.78 75.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.312 179.628 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.47 ' O ' ' HG2' ' A' ' 101' ' ' LYS . 67.3 m-20 -76.14 -31.02 58.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.08 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -62.23 -36.27 81.46 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.313 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.519 HD12 ' CG2' ' A' ' 16' ' ' ILE . 22.1 mm -70.57 -49.15 54.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.957 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.555 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 4.4 pttt -64.8 -27.51 68.93 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.923 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.456 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.1 OUTLIER -78.55 -41.91 30.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.109 179.564 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.488 HG21 HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -71.4 -41.4 69.66 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.641 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.682 ' HA ' HD12 ' A' ' 107' ' ' ILE . 13.9 mt -60.31 -41.1 92.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.801 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.761 ' HA ' HD12 ' A' ' 108' ' ' ILE . 1.5 mt-30 -61.87 -30.23 70.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.939 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -68.48 -36.27 78.7 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.118 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.058 HD13 HD13 ' A' ' 42' ' ' LEU . 6.6 mt -70.72 -46.65 68.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.476 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.87 HG22 ' HD3' ' A' ' 112' ' ' LYS . 2.5 mt -57.48 -61.09 1.42 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 CA-C-O 121.803 0.811 . . . . 0.0 109.385 179.157 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.4 p -50.28 -31.71 14.98 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.199 -1.364 . . . . 0.0 110.91 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 52.5 mtt-85 -68.63 -33.53 74.17 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.832 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.508 ' CE2' HG22 ' A' ' 107' ' ' ILE . 20.1 m-85 -92.19 -33.92 14.51 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.921 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.87 ' HD3' HG22 ' A' ' 108' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.788 179.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.0 m . . . . . 0 C--O 1.23 0.031 0 CA-C-O 120.854 0.359 . . . . 0.0 110.951 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 64.2 m80 -126.43 33.27 5.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.15 0.5 . . . . 0.0 110.924 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.539 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 62.9 p 179.14 115.73 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.889 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.425 ' O ' ' C ' ' A' ' 6' ' ' ALA . . . -146.64 113.45 0.67 Allowed Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.929 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.552 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -32.93 120.09 0.34 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.769 0.319 . . . . 0.0 111.269 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.538 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -136.28 151.32 49.52 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -178.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.593 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.2 mp -98.54 125.36 51.92 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.27 0 CA-C-O 121.063 0.458 . . . . 0.0 110.523 179.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.504 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 7.4 t80 -117.05 130.13 56.47 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.015 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 58.58 33.81 23.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.814 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 69.8 mttt 75.46 1.6 3.66 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.149 -178.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.467 ' O ' HG23 ' A' ' 8' ' ' ILE . 31.3 t -101.44 148.4 7.34 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.745 0 CA-C-N 116.031 -0.532 . . . . 0.0 109.63 179.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.593 ' HA ' HG13 ' A' ' 8' ' ' ILE . 78.7 p -86.83 146.21 26.3 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-O 121.446 0.641 . . . . 0.0 111.523 -179.368 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.444 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . -175.6 -179.1 45.92 Favored Glycine 0 N--CA 1.441 -0.984 0 CA-C-N 115.056 -0.975 . . . . 0.0 111.764 -179.528 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.552 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 7.0 mm -106.21 136.01 42.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 120.849 0.357 . . . . 0.0 110.062 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.695 HG12 HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -106.6 117.85 53.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.836 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.475 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -123.61 132.13 53.79 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.337 0.589 . . . . 0.0 111.596 -178.049 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.469 HD13 HG22 ' A' ' 103' ' ' THR . 46.1 mt -102.46 133.0 47.36 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.058 -179.409 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -124.35 114.18 19.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.012 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -88.35 5.61 41.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.251 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -78.37 -18.23 55.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.911 0.386 . . . . 0.0 110.358 179.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -98.07 145.43 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.904 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.413 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 1.2 t -121.81 116.25 30.37 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.991 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.489 ' HG2' HG23 ' A' ' 41' ' ' VAL . 72.1 Cg_endo -76.22 149.79 92.35 Favored 'Cis proline' 0 C--N 1.35 0.612 0 C-N-CA 123.211 -1.579 . . . . 0.0 112.108 -0.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.14 137.56 5.96 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.801 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -128.35 164.18 23.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.148 0.499 . . . . 0.0 111.803 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.695 HD21 HG12 ' A' ' 16' ' ' ILE . 4.8 tt -121.12 129.19 53.18 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.696 179.262 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.0 m -116.5 129.0 55.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.137 0.494 . . . . 0.0 111.902 -179.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.499 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 57.8 t90 -100.37 125.68 46.66 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.139 179.083 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.19 116.51 23.52 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.638 179.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.403 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 11.2 m -44.42 158.36 0.05 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.704 0.288 . . . . 0.0 110.975 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.425 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -66.34 -39.45 89.22 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.494 0.664 . . . . 0.0 109.263 179.974 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 48.0 p30 -85.51 -20.8 29.13 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.213 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.77 32.71 12.4 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.649 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -99.5 -23.56 15.06 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.839 0.352 . . . . 0.0 111.467 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.3 mtmt -130.12 142.42 50.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.07 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 14.4 p -139.04 136.71 42.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.22 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.504 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 82.0 t60 -136.39 146.34 46.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.007 0.432 . . . . 0.0 111.347 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 43.5 m -127.47 136.95 52.5 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.951 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 92.6 t -132.38 140.87 46.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-O 121.018 0.437 . . . . 0.0 111.599 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.682 HG13 ' CG2' ' A' ' 44' ' ' THR . 0.8 OUTLIER -87.75 118.15 32.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 178.026 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 1.043 HD13 HD13 ' A' ' 107' ' ' ILE . 46.6 mt -71.61 -29.7 64.97 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -178.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.455 ' CB ' ' HB2' ' A' ' 24' ' ' PRO . 1.5 t -55.51 -22.22 20.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.671 0.272 . . . . 0.0 111.684 -179.39 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.682 ' CG2' HG13 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -88.69 -24.96 22.6 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.786 0.327 . . . . 0.0 111.252 -179.653 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.79 HD12 ' HB3' ' A' ' 62' ' ' LEU . 50.5 mm -56.04 91.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.064 0.459 . . . . 0.0 111.021 -179.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 63' ' ' ILE . 7.1 t0 -78.59 -25.82 45.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.598 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.408 ' HB2' HG13 ' A' ' 63' ' ' ILE . 7.2 mmmt -148.32 148.59 30.58 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.053 0.454 . . . . 0.0 111.518 -179.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.775 HD11 ' HB3' ' A' ' 104' ' ' LEU . 41.2 mt -115.68 124.37 50.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.498 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -115.15 137.84 51.57 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.76 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.739 ' HB2' ' CD1' ' A' ' 60' ' ' LEU . . . -145.89 151.27 37.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.014 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 55.1 p -75.72 130.31 79.3 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.58 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.32 158.46 44.64 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.583 2.189 . . . . 0.0 112.489 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.59 -43.0 97.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.066 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.1 m -59.35 -27.59 66.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.072 0.463 . . . . 0.0 110.822 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 31.5 t -82.31 119.55 24.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.896 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -57.18 -18.27 14.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.44 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 35.8 mmtm -60.45 155.85 17.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.854 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 17.3 mtp -143.02 79.9 1.66 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.794 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -147.55 167.22 25.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.061 0.458 . . . . 0.0 111.63 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.739 ' CD1' ' HB2' ' A' ' 50' ' ' ALA . 13.2 tp -136.46 128.66 29.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.034 179.458 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -114.26 122.03 45.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.945 0.402 . . . . 0.0 111.788 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.79 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.3 OUTLIER -97.24 139.6 32.97 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.924 179.014 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.507 HD13 ' HG2' ' A' ' 86' ' ' ARG . 0.9 OUTLIER -115.66 119.22 61.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.017 -179.686 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -89.49 151.77 22.13 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.248 179.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.8 mttm -59.06 135.51 57.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.805 0.336 . . . . 0.0 110.762 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.786 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.3 p -79.62 -167.55 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.169 0.509 . . . . 0.0 111.193 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.786 ' H ' HG22 ' A' ' 66' ' ' VAL . 54.2 p-10 -148.44 59.51 1.08 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.638 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -56.01 -22.55 27.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.387 -179.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.4 t -59.62 -17.52 34.07 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.015 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.8 mmtp -71.01 -50.68 31.51 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.761 0.315 . . . . 0.0 111.092 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.4 mmtm 63.43 95.22 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.712 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 31.6 mmt180 -99.65 168.64 9.8 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.804 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 7.9 mttt -124.91 146.69 49.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.96 0.409 . . . . 0.0 111.08 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -86.28 171.93 10.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.8 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -62.15 -18.11 59.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.343 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -85.95 4.38 37.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.569 0.223 . . . . 0.0 111.425 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 83.54 3.22 89.87 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.78 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.402 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 24.2 p30 -91.26 168.14 11.81 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.738 0.304 . . . . 0.0 110.763 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -94.89 153.38 17.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.851 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.44 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.2 m -138.18 158.9 32.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.969 0.414 . . . . 0.0 111.222 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 38.5 t -101.93 98.74 10.52 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.563 178.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.44 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 93.5 Cg_exo -42.81 145.34 1.12 Allowed 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.537 2.158 . . . . 0.0 112.779 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.449 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 11.4 mttp -84.35 148.58 53.01 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.054 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.578 ' HA ' HG23 ' A' ' 66' ' ' VAL . 16.4 Cg_exo -73.06 162.4 40.96 Favored 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 123.509 2.806 . . . . 0.0 112.741 -178.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -65.45 144.03 57.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.802 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.507 ' HG2' HD13 ' A' ' 63' ' ' ILE . 32.9 mtp180 -145.12 119.92 9.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.935 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 58.2 m-70 -107.4 159.11 16.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.61 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.1 ttt -130.44 132.03 45.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.029 0.442 . . . . 0.0 111.345 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.663 ' CE2' HD11 ' A' ' 16' ' ' ILE . 87.6 m-85 -138.62 145.99 41.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.459 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -118.96 133.87 55.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.809 0.338 . . . . 0.0 111.1 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.502 ' N ' ' CD1' ' A' ' 91' ' ' PHE . 1.4 m-85 -127.5 158.24 37.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.573 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 53.5 m-20 -115.79 25.53 10.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.936 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.478 ' HB3' HG23 ' A' ' 96' ' ' VAL . 47.3 t-20 -156.68 108.03 2.42 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.487 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 8.9 tpp180 -46.86 -29.87 2.21 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.005 0.431 . . . . 0.0 111.288 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.2 -54.0 9.54 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.537 -179.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.478 HG23 ' HB3' ' A' ' 93' ' ' ASN . 58.1 t -53.63 -49.66 54.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.827 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.432 ' HB3' ' CG ' ' A' ' 91' ' ' PHE . 18.7 ptm -63.98 -37.22 86.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.0 0.429 . . . . 0.0 110.064 179.386 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -66.38 -31.2 71.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.511 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -67.89 -40.46 83.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.931 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.67 HG22 HD12 ' A' ' 104' ' ' LEU . 24.7 mm -66.43 -49.77 72.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.423 179.273 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 3.9 pttt -66.01 -27.28 68.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.46 179.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 64.6 mtp -78.25 -40.19 37.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.542 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.469 HG22 HD13 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -79.11 -37.18 39.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.514 179.735 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.807 ' HA ' HD12 ' A' ' 107' ' ' ILE . 12.0 mt -61.59 -39.56 91.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.767 179.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.756 ' HA ' HD12 ' A' ' 108' ' ' ILE . 1.0 OUTLIER -61.65 -29.1 69.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.878 179.874 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 99.6 mm-40 -69.23 -33.8 73.83 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.811 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.043 HD13 HD13 ' A' ' 42' ' ' LEU . 4.0 mt -72.52 -44.48 61.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.308 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.87 HG22 ' HD3' ' A' ' 112' ' ' LYS . 2.6 mt -58.84 -61.18 1.52 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.551 0 CA-C-O 121.764 0.792 . . . . 0.0 109.474 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.1 t -50.91 -28.84 10.51 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.16 -1.382 . . . . 0.0 110.943 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 49.3 mtt180 -70.32 -33.7 71.82 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.762 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.477 ' CE2' HG22 ' A' ' 107' ' ' ILE . 19.9 m-85 -92.32 -35.33 13.8 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.938 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.87 ' HD3' HG22 ' A' ' 108' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.741 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.2 t . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.664 0.269 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.449 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 55.1 m80 -117.37 37.9 3.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.982 0.42 . . . . 0.0 111.265 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.521 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 1.2 m -166.68 176.62 7.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.671 179.258 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 159.08 126.09 0.84 Allowed Glycine 0 N--CA 1.444 -0.814 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.321 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.606 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -53.65 111.65 0.77 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.018 0.437 . . . . 0.0 111.192 -179.689 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.631 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -125.81 150.27 47.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.831 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.551 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -100.14 125.78 53.8 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.267 0 CA-C-O 120.979 0.418 . . . . 0.0 110.222 179.049 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.507 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 6.1 t80 -112.93 131.16 55.85 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.284 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.0 mt-10 55.07 34.25 22.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.859 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.0 mttp 76.44 0.8 3.26 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.365 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.527 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.4 t -98.78 154.25 4.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 178.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.551 ' HA ' HG13 ' A' ' 8' ' ' ILE . 83.6 p -96.32 149.0 22.17 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 121.721 0.772 . . . . 0.0 112.742 -178.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.469 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.7 -179.69 46.72 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 114.449 -1.25 . . . . 0.0 110.292 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.606 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.71 144.35 15.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 117.673 0.736 . . . . 0.0 110.529 179.36 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.825 HG12 HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -106.81 118.55 54.77 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 CA-C-N 115.358 -0.837 . . . . 0.0 108.835 179.577 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.521 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -121.14 132.31 54.78 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.355 -178.689 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.514 ' CG1' HD12 ' A' ' 27' ' ' LEU . 59.3 mt -104.08 140.1 23.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.074 -179.163 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -132.51 111.46 11.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.862 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -90.36 5.2 48.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.325 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -78.9 -17.76 55.02 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.954 0.406 . . . . 0.0 110.36 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.62 142.97 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.947 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.426 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.5 t -115.81 116.77 40.47 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.834 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.426 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 2.1 Cg_endo -80.08 144.65 69.92 Favored 'Cis proline' 0 C--N 1.348 0.534 0 C-N-CA 123.707 -1.372 . . . . 0.0 111.933 0.142 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.78 139.58 5.25 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.886 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -133.49 167.27 20.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.088 0.47 . . . . 0.0 111.661 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.825 HD21 HG12 ' A' ' 16' ' ' ILE . 5.6 tt -120.97 128.78 53.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.639 179.348 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.3 m -114.74 127.48 55.77 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.208 0.528 . . . . 0.0 112.085 -178.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.496 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 56.3 t90 -100.43 128.8 46.39 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.8 179.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 14.6 tpt180 -123.51 116.04 22.52 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.79 0.329 . . . . 0.0 110.976 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.469 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 30.9 t -45.37 164.36 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.062 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.41 -41.56 66.12 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.482 0.658 . . . . 0.0 109.507 179.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -82.32 -22.17 35.72 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.792 -1.094 . . . . 0.0 111.027 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.72 32.99 10.42 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.458 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -106.82 -20.18 13.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.712 0.291 . . . . 0.0 111.433 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.487 ' HE2' HG21 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -129.46 135.0 48.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.799 0.333 . . . . 0.0 111.109 -179.814 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 13.2 p -139.15 138.93 40.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.042 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.507 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 77.5 t60 -136.81 146.24 45.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.082 0.468 . . . . 0.0 111.364 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 48.2 m -127.15 132.77 50.46 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.073 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 95.7 t -124.32 140.87 46.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.457 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.61 HG22 HG23 ' A' ' 44' ' ' THR . 2.1 p -85.2 117.33 30.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 178.1 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 1.031 HD13 HD13 ' A' ' 107' ' ' ILE . 68.5 mt -75.7 -30.42 59.33 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.124 -178.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.409 ' HB3' ' HB3' ' A' ' 24' ' ' PRO . 60.5 p -56.12 -21.74 24.2 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -179.004 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.61 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -93.91 -24.73 17.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.742 0.306 . . . . 0.0 111.287 -179.704 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.829 HD12 ' HB3' ' A' ' 62' ' ' LEU . 42.7 mm -51.17 93.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.983 0.421 . . . . 0.0 110.918 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -77.54 -27.68 51.7 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.511 -179.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.61 ' CE ' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -140.3 159.15 42.83 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 121.201 0.524 . . . . 0.0 111.381 -179.298 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.748 HD11 ' HB3' ' A' ' 104' ' ' LEU . 27.4 mt -126.89 124.24 39.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.953 178.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.432 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 79.9 mt-30 -120.81 136.9 54.78 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.977 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.402 ' HB2' ' HG ' ' A' ' 60' ' ' LEU . . . -148.23 151.23 35.12 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.115 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 60.5 p -75.56 126.82 87.01 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.44 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -59.51 155.85 39.61 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.55 2.167 . . . . 0.0 112.515 -179.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.48 -43.08 97.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.091 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 93.6 p -59.59 -27.62 66.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.038 0.447 . . . . 0.0 110.722 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 26.3 t -80.62 120.9 25.16 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.954 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -56.65 -18.48 12.35 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.334 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 30.4 mmtt -66.79 156.49 35.38 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.872 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.496 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 31.7 mtp -143.0 89.89 2.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.743 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.466 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 44.3 mtm -155.74 156.36 34.72 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.052 0.453 . . . . 0.0 111.817 -179.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.553 HD11 ' HD2' ' A' ' 101' ' ' LYS . 0.1 OUTLIER -131.61 123.9 28.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.38 179.707 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.432 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 39.0 mtp180 -107.82 127.08 53.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.847 0.355 . . . . 0.0 111.333 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.829 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -111.04 123.45 50.22 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.943 -179.929 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.61 HD13 ' CE ' ' A' ' 47' ' ' LYS . 3.9 mp -109.64 136.04 46.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.831 0.348 . . . . 0.0 111.136 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.9 -169.42 38.21 Favored Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.378 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.91 143.43 34.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.759 0.314 . . . . 0.0 110.807 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.747 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.3 p -99.97 -162.25 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.045 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.747 ' H ' HG22 ' A' ' 66' ' ' VAL . 14.3 t70 -175.14 70.97 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.254 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.558 ' OE1' HG12 ' A' ' 81' ' ' VAL . 52.7 mm-40 -56.9 -20.61 24.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.492 -179.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 27.1 t -57.51 -18.59 19.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.206 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.3 mmmt -57.76 -46.77 84.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.068 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? 62.29 94.32 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.856 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 57.7 mmm-85 -107.64 154.92 20.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.822 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -119.11 145.33 46.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.908 0.385 . . . . 0.0 111.041 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -84.85 171.27 12.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.865 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -61.97 -18.09 59.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.384 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -85.41 4.67 34.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.551 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 81.61 6.57 89.02 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.722 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -94.23 162.07 14.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.707 0.289 . . . . 0.0 110.681 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -94.97 151.83 18.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.938 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.459 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.3 m -135.41 158.93 40.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.15 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.558 HG12 ' OE1' ' A' ' 68' ' ' GLU . 19.4 t -101.05 98.73 9.13 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.708 178.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.459 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 92.1 Cg_exo -42.81 145.52 1.07 Allowed 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.562 2.175 . . . . 0.0 112.845 -179.005 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.411 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 2.6 tttt -104.48 150.84 38.93 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.715 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 16.9 Cg_exo -72.43 147.14 46.09 Favored 'Trans proline' 0 N--CA 1.464 -0.207 0 C-N-CA 123.524 2.816 . . . . 0.0 112.699 -178.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -65.63 133.73 51.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.905 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.52 ' HG2' ' CG1' ' A' ' 63' ' ' ILE . 10.4 mtm180 -123.94 124.43 42.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.767 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -93.49 159.15 15.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.554 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 25.4 ttt -133.45 128.99 36.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.87 0.367 . . . . 0.0 111.381 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.623 ' CE1' HD11 ' A' ' 16' ' ' ILE . 97.9 m-85 -139.68 148.99 43.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.603 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.466 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 2.8 t -125.64 124.17 40.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.841 0.353 . . . . 0.0 110.937 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.631 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 3.8 m-85 -112.44 170.61 8.05 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.914 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.496 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 27.7 p30 -128.76 26.09 5.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.146 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.4 ' CB ' HG23 ' A' ' 96' ' ' VAL . 84.8 m-20 -153.53 112.05 3.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.65 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.71 -33.0 63.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.208 0.528 . . . . 0.0 110.902 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.19 -49.64 54.81 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.162 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.4 HG23 ' CB ' ' A' ' 93' ' ' ASN . 47.9 t -58.89 -40.64 80.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.556 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.438 ' SD ' HD12 ' A' ' 60' ' ' LEU . 0.6 OUTLIER -63.48 -33.56 75.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.431 179.508 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -65.44 -35.4 80.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.741 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -69.28 -41.19 77.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.806 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.445 HG22 HD12 ' A' ' 104' ' ' LEU . 21.5 mm -62.76 -52.02 64.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.738 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.553 ' HD2' HD11 ' A' ' 60' ' ' LEU . 5.6 mtpp -64.55 -27.87 69.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.723 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 36.3 mtm -78.42 -36.88 45.06 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.062 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.512 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.5 OUTLIER -82.06 -38.96 24.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.009 -179.792 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.836 ' CD2' HD22 ' A' ' 42' ' ' LEU . 16.2 mt -64.08 -39.67 94.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.841 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.711 ' HA ' HD12 ' A' ' 108' ' ' ILE . 2.3 mt-30 -64.46 -29.34 70.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.865 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -69.37 -31.64 70.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.921 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.031 HD13 HD13 ' A' ' 42' ' ' LEU . 5.9 mt -74.89 -46.43 40.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.282 -179.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.711 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.2 mt -58.22 -61.24 1.44 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.589 0 CA-C-O 121.689 0.757 . . . . 0.0 109.343 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.5 m -50.53 -28.91 9.39 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.325 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.92 -41.56 97.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.449 179.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 75.5 m-85 -83.64 -29.65 27.51 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.344 179.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.473 ' CE ' HG22 ' A' ' 108' ' ' ILE . 18.9 mttt . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.502 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.0 t . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.862 0.363 . . . . 0.0 110.932 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 52.8 m80 62.19 32.6 17.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.218 0.533 . . . . 0.0 110.876 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.589 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 75.1 p 178.11 162.41 0.63 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.572 179.177 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.419 ' CA ' HG13 ' A' ' 96' ' ' VAL . . . 161.6 116.27 0.39 Allowed Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.716 -0.755 . . . . 0.0 112.535 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.639 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -46.88 102.87 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.104 0.478 . . . . 0.0 111.298 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.823 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -117.64 151.79 36.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.931 -178.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.556 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.9 OUTLIER -98.78 123.88 51.65 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.26 0 CA-C-O 121.101 0.477 . . . . 0.0 110.373 178.918 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.504 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 14.3 t80 -112.26 130.17 56.02 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.045 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 56.52 34.35 24.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.731 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.8 mtpm? 75.88 1.7 3.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.287 -179.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.511 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.8 t -100.8 154.57 4.56 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.596 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.001 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.556 ' HA ' HG13 ' A' ' 8' ' ' ILE . 89.5 p -95.66 149.42 21.48 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 121.549 0.69 . . . . 0.0 112.646 -178.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.465 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 174.54 -179.73 45.68 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 114.645 -1.161 . . . . 0.0 110.41 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.639 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.83 141.91 20.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 117.795 0.797 . . . . 0.0 110.579 179.426 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.865 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.77 118.48 54.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 179.62 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.5 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -121.83 130.44 53.39 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.525 -178.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.862 HG23 HD11 ' A' ' 42' ' ' LEU . 77.2 mt -101.45 129.7 52.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.12 -179.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 51.6 t30 -116.1 111.44 20.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.034 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -89.75 7.03 38.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.165 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -78.94 -18.47 53.74 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.852 0.358 . . . . 0.0 110.384 179.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.502 ' CG2' ' N ' ' A' ' 23' ' ' SER . 0.5 OUTLIER -100.19 159.77 3.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.892 -179.961 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.502 ' N ' ' CG2' ' A' ' 22' ' ' VAL . 2.0 t -131.04 117.11 16.98 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.04 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.449 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 71.8 Cg_endo -77.12 147.48 85.89 Favored 'Cis proline' 0 C--N 1.349 0.581 0 C-N-CA 123.36 -1.517 . . . . 0.0 112.188 0.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.22 136.51 9.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.727 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -128.07 166.89 17.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.222 0.534 . . . . 0.0 111.673 -179.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.865 HD21 HG12 ' A' ' 16' ' ' ILE . 5.0 tt -121.27 132.97 55.12 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.852 179.411 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 49.8 m -119.68 126.95 52.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.155 0.502 . . . . 0.0 112.031 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.482 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 57.9 t90 -100.58 130.31 46.62 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.884 179.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 24.4 tpt85 -125.25 114.99 19.67 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.837 0.351 . . . . 0.0 110.725 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.465 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 72.5 p -45.47 165.37 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.06 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.59 -42.35 58.87 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.481 0.658 . . . . 0.0 109.795 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -78.55 -22.74 46.78 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.101 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.52 33.44 10.27 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.381 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -111.36 -18.67 12.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.56 0.219 . . . . 0.0 111.588 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.506 ' NZ ' HG21 ' A' ' 12' ' ' VAL . 6.3 mtmt -128.65 134.57 48.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.909 0.385 . . . . 0.0 111.187 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 11.0 p -139.26 141.83 34.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.038 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.504 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 71.0 t60 -137.6 146.1 43.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.125 0.488 . . . . 0.0 111.286 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 37.2 m -127.74 135.11 49.7 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.97 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.6 t -130.72 140.86 47.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 121.008 0.432 . . . . 0.0 111.548 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.772 HG13 ' CG2' ' A' ' 44' ' ' THR . 1.3 p -86.37 118.11 32.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.178 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 1.013 HD13 HD13 ' A' ' 107' ' ' ILE . 63.9 mt -70.89 -31.2 67.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.239 -0.437 . . . . 0.0 112.159 -178.34 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.439 ' CB ' ' HB2' ' A' ' 24' ' ' PRO . 2.0 t -52.67 -23.79 7.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.759 0.314 . . . . 0.0 111.543 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.772 ' CG2' HG13 ' A' ' 41' ' ' VAL . 0.2 OUTLIER -86.25 -25.94 25.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.092 -179.866 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.527 HG12 ' HA ' ' A' ' 42' ' ' LEU . 41.6 mm -49.62 98.8 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.045 0.45 . . . . 0.0 111.116 -179.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -94.22 -21.01 19.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.583 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.408 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 61.2 mttm -156.61 137.68 13.61 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.976 0.417 . . . . 0.0 111.362 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.707 HD11 ' HB3' ' A' ' 104' ' ' LEU . 60.0 mt -109.37 124.26 50.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.595 179.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.408 ' HB3' ' HB3' ' A' ' 61' ' ' ARG . 4.8 tp60 -109.66 130.93 55.47 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.55 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.527 ' HB3' ' NZ ' ' A' ' 101' ' ' LYS . . . -141.87 140.79 32.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.192 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.465 HG23 ' O ' ' A' ' 59' ' ' MET . 71.3 p -75.7 124.0 88.59 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.523 179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -61.51 160.31 28.43 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.578 2.185 . . . . 0.0 112.598 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.58 -42.97 97.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.095 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 86.2 p -60.26 -27.66 67.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.041 0.448 . . . . 0.0 110.603 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 28.7 t -81.22 119.9 24.2 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.806 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.1 tp10 -55.88 -18.86 9.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.386 179.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.1 mmtt -60.42 151.62 27.65 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.895 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.462 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 45.6 mtp -143.14 89.46 2.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.606 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.886 ' HG3' ' HE2' ' A' ' 88' ' ' MET . 3.0 tmm? -172.85 147.22 1.67 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.001 0.429 . . . . 0.0 111.469 -179.558 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.741 HD11 ' HB2' ' A' ' 101' ' ' LYS . 0.4 OUTLIER -114.39 134.53 54.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.309 179.687 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.408 ' HB3' ' HB3' ' A' ' 49' ' ' GLN . 0.5 OUTLIER -120.82 124.22 44.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.036 0.446 . . . . 0.0 111.742 -179.519 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.5 HD11 HD23 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -94.89 144.14 25.9 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.433 179.386 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.558 HD13 ' HG2' ' A' ' 86' ' ' ARG . 1.2 mm -118.27 124.01 72.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.019 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -92.17 154.53 22.42 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.534 -0.841 . . . . 0.0 112.367 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 37.3 mttt -67.75 155.56 39.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.837 0.351 . . . . 0.0 110.851 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.72 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.3 p -121.16 -162.31 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.996 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.72 ' H ' HG22 ' A' ' 66' ' ' VAL . 40.6 t0 -177.67 71.11 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.234 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.672 ' HB3' HG23 ' A' ' 81' ' ' VAL . 82.0 mt-10 -55.13 -23.38 20.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.341 -179.391 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.9 m -62.93 -15.04 53.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.935 179.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.3 mmtt -66.81 -43.86 82.75 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.709 0.29 . . . . 0.0 111.038 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.4 mptt 60.67 93.09 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.781 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.434 ' HD2' HG22 ' A' ' 80' ' ' VAL . 0.0 OUTLIER -104.47 137.91 41.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.87 -179.812 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.9 mmtp -83.7 145.33 28.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.088 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.472 ' CG ' HG11 ' A' ' 80' ' ' VAL . 9.0 m-20 -88.02 176.82 7.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.975 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -67.01 -15.99 64.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.404 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -88.38 -7.9 55.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.242 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 94.37 9.27 59.25 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.626 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -103.29 145.7 29.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.791 0.329 . . . . 0.0 110.864 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -78.4 140.87 38.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.963 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.472 HG11 ' CG ' ' A' ' 74' ' ' ASP . 1.3 m -140.56 152.63 21.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.191 0.52 . . . . 0.0 111.387 -179.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.672 HG23 ' HB3' ' A' ' 68' ' ' GLU . 2.3 p -85.29 109.03 18.17 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.554 178.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.444 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 52.2 Cg_exo -53.22 145.55 43.4 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.128 1.885 . . . . 0.0 112.483 -178.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 2.9 mmpt? -89.97 154.52 47.52 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.997 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 19.2 Cg_exo -71.48 144.26 44.76 Favored 'Trans proline' 0 N--CA 1.465 -0.189 0 C-N-CA 123.514 2.81 . . . . 0.0 112.685 -178.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -66.43 141.93 57.76 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.97 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.558 ' HG2' HD13 ' A' ' 63' ' ' ILE . 16.9 mtm180 -144.78 120.0 10.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.651 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.422 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 68.3 m-70 -109.55 159.05 17.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.538 179.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.886 ' HE2' ' HG3' ' A' ' 59' ' ' MET . 13.7 ttt -133.62 139.96 46.82 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.076 0.465 . . . . 0.0 111.401 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.639 ' CE2' HD11 ' A' ' 16' ' ' ILE . 91.7 m-85 -148.71 125.35 11.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.146 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 27.0 t -101.63 134.52 44.64 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.967 0.413 . . . . 0.0 111.542 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.823 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 2.2 m-85 -123.37 130.3 52.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.583 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.462 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 12.9 m120 -74.3 -18.57 60.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.353 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.527 ' HB2' HG23 ' A' ' 96' ' ' VAL . 96.8 m-20 -114.51 114.36 25.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.827 0.346 . . . . 0.0 110.825 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.94 -26.64 26.46 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.057 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.14 -46.04 62.34 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.255 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.527 HG23 ' HB2' ' A' ' 93' ' ' ASN . 61.4 t -58.49 -52.36 60.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.622 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.458 ' HB3' ' CG ' ' A' ' 91' ' ' PHE . 9.8 ptm -60.24 -32.35 71.06 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.418 ' O ' ' HE2' ' A' ' 102' ' ' MET . 47.3 t0 -61.55 -35.02 76.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.388 179.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.437 ' O ' ' HB ' ' A' ' 103' ' ' THR . 65.6 m-80 -71.66 -44.42 64.34 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.459 179.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.581 HG22 HD12 ' A' ' 104' ' ' LEU . 23.2 mm -60.53 -52.1 65.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.14 0.495 . . . . 0.0 110.679 179.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.741 ' HB2' HD11 ' A' ' 60' ' ' LEU . 1.3 ttmt -62.2 -30.88 71.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.799 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.418 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 41.8 mtm -78.56 -40.45 34.76 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.855 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.437 ' HB ' ' O ' ' A' ' 99' ' ' ASN . 0.6 OUTLIER -76.06 -42.99 45.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.874 -179.879 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.757 ' CD2' HD22 ' A' ' 42' ' ' LEU . 18.0 mt -60.73 -37.07 80.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.772 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.748 ' HA ' HD12 ' A' ' 108' ' ' ILE . 1.1 mm-40 -63.43 -29.75 70.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.836 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -67.4 -37.1 82.57 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.972 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.013 HD13 HD13 ' A' ' 42' ' ' LEU . 3.5 mt -68.51 -44.08 83.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.294 -179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.914 HG22 ' CD ' ' A' ' 112' ' ' LYS . 2.5 mt -60.83 -61.21 1.66 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.589 0 CA-C-O 121.847 0.832 . . . . 0.0 109.393 179.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 27.5 m -53.27 -28.85 29.9 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.172 -1.376 . . . . 0.0 110.853 179.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 51.4 mtt-85 -72.45 -33.74 67.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.666 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.452 ' CE2' ' CG2' ' A' ' 107' ' ' ILE . 22.3 m-30 -87.99 -31.12 19.52 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.842 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.914 ' CD ' HG22 ' A' ' 108' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.289 0 CA-C-O 121.045 0.45 . . . . 0.0 110.64 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.4 t . . . . . 0 CA--C 1.527 0.078 0 CA-C-O 120.866 0.365 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 78.0 m80 63.59 32.68 13.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.244 0.545 . . . . 0.0 111.039 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.653 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 80.6 p 178.47 172.99 0.7 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.688 178.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.412 ' CA ' ' CG1' ' A' ' 96' ' ' VAL . . . 153.17 117.2 0.67 Allowed Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.028 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.589 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -39.82 117.85 0.8 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.897 0.379 . . . . 0.0 111.224 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.654 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -134.47 152.03 51.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.738 -179.114 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.6 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.2 mp -98.39 126.69 51.41 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.263 0 CA-C-O 121.138 0.494 . . . . 0.0 110.78 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.507 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 9.5 t80 -118.82 128.66 54.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.724 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.439 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 82.4 mt-10 59.02 36.79 24.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.595 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.439 ' HB2' ' O ' ' A' ' 10' ' ' GLU . 1.6 mtmt 72.13 2.43 4.31 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.31 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.466 ' O ' ' N ' ' A' ' 9' ' ' PHE . 30.0 t -102.37 146.68 10.03 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.71 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.6 ' HA ' HG13 ' A' ' 8' ' ' ILE . 88.0 p -85.96 146.71 26.56 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.595 -179.294 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.46 ' O ' ' N ' ' A' ' 7' ' ' ALA . . . -177.33 -179.1 47.47 Favored Glycine 0 N--CA 1.442 -0.907 0 CA-C-N 115.168 -0.924 . . . . 0.0 111.758 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.589 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.0 mm -104.48 137.57 32.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-O 120.951 0.405 . . . . 0.0 110.229 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.781 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.73 118.22 54.05 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 178.758 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.562 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -125.63 124.44 41.19 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.162 0.506 . . . . 0.0 111.484 -178.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.535 ' CG1' HD12 ' A' ' 27' ' ' LEU . 76.5 mt -98.72 139.24 21.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.04 -179.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -130.93 112.31 12.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.954 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -86.62 0.63 54.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.341 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -76.57 -17.79 59.02 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 121.029 0.442 . . . . 0.0 110.283 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -95.99 134.86 32.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.858 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.404 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 1.0 OUTLIER -111.37 116.68 50.59 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.016 -179.971 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.44 ' HG2' HG23 ' A' ' 41' ' ' VAL . 95.7 Cg_endo -78.21 154.05 92.9 Favored 'Cis proline' 0 C--N 1.349 0.554 0 C-N-CA 123.387 -1.505 . . . . 0.0 112.125 0.003 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.423 ' HB1' HD12 ' A' ' 42' ' ' LEU . . . -49.3 138.34 12.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.891 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -134.26 162.54 31.9 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.174 0.512 . . . . 0.0 111.517 -179.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.781 HD21 HG12 ' A' ' 16' ' ' ILE . 5.8 tt -121.25 125.39 46.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.536 179.244 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.2 m -113.24 126.95 55.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.156 0.503 . . . . 0.0 112.295 -178.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.47 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 64.2 t90 -100.41 128.97 46.33 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.914 178.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.673 ' HG3' HG22 ' A' ' 37' ' ' VAL . 15.9 ttm105 -128.31 117.94 22.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.824 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.444 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 17.0 t -44.73 155.88 0.09 Allowed 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.768 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.447 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -65.06 -39.62 93.53 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.529 0.681 . . . . 0.0 109.349 -179.925 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -79.99 -25.32 40.35 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 114.634 -1.166 . . . . 0.0 111.132 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 90.97 31.65 9.71 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.662 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -101.9 -21.2 14.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.61 0.243 . . . . 0.0 111.442 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 11.8 mtmt -128.69 138.33 52.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.764 0.316 . . . . 0.0 111.141 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.673 HG22 ' HG3' ' A' ' 30' ' ' ARG . 47.4 t -139.09 132.85 39.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.032 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.507 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 65.5 t60 -136.65 146.31 45.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.137 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 49.0 m -127.68 139.1 52.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.107 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 96.1 t -128.49 140.91 47.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.183 0.516 . . . . 0.0 111.674 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.629 HG13 HG23 ' A' ' 44' ' ' THR . 2.0 p -87.64 118.17 32.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.386 -0.825 . . . . 0.0 109.22 178.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 1.097 HD13 HD13 ' A' ' 107' ' ' ILE . 89.2 mt -73.5 -30.72 63.31 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -178.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.409 ' HB2' ' HB2' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -53.14 -24.3 10.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.819 0.342 . . . . 0.0 111.69 -179.486 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.629 HG23 HG13 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -92.58 -24.67 18.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.103 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.768 HD12 ' HB3' ' A' ' 62' ' ' LEU . 39.2 mm -61.25 85.44 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.712 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -70.81 -29.04 65.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.543 -179.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.66 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 10.0 mmmt -139.35 146.44 40.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.024 0.44 . . . . 0.0 111.789 -179.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.645 HD23 ' HG2' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -126.74 126.36 43.34 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.741 179.138 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -119.87 149.45 42.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.971 0.415 . . . . 0.0 111.236 -179.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.701 ' HB3' ' NZ ' ' A' ' 101' ' ' LYS . . . -148.08 146.76 28.97 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.953 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 54.6 p -75.87 122.73 87.57 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.332 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -61.42 160.32 27.99 Favored 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 122.597 2.198 . . . . 0.0 112.578 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.453 ' HB2' ' NH2' ' A' ' 94' ' ' ARG . . . -59.68 -42.75 93.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.103 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 86.3 p -57.92 -26.94 62.87 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.044 0.45 . . . . 0.0 110.783 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.7 t -85.69 118.57 25.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.845 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -56.69 -18.5 12.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.542 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -63.54 147.1 52.31 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.954 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.44 ' HE3' ' HB3' ' A' ' 58' ' ' MET . 19.6 mmm -133.74 85.0 2.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.592 -179.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.426 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 31.7 mtm -154.67 165.87 35.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.229 0.538 . . . . 0.0 112.002 -179.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.445 HD12 ' HB2' ' A' ' 50' ' ' ALA . 2.8 tp -133.79 126.81 31.4 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.997 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.1 ttt180 -117.1 127.18 53.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.928 0.394 . . . . 0.0 111.882 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.768 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -106.42 144.1 33.59 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.269 179.482 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.66 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 2.0 mm -111.27 126.04 68.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.818 0.342 . . . . 0.0 111.211 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -91.25 131.91 11.01 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.2 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -44.3 137.84 3.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.847 0.356 . . . . 0.0 111.245 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.757 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.4 p -93.85 -162.39 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.052 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.757 ' H ' HG22 ' A' ' 66' ' ' VAL . 52.1 t0 -167.38 73.28 0.12 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.088 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 85.6 mt-10 -55.11 -21.97 14.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.439 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 37.1 m -57.06 -19.01 16.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.174 179.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.78 -54.57 43.56 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.986 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.5 mmtt 60.92 93.64 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.838 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 10.8 mtt180 -111.22 143.83 41.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.835 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.1 mttp -98.48 145.21 27.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.168 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -87.65 175.25 7.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.899 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -64.31 -19.52 65.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.39 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 51.8 mp0 -86.95 6.39 32.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.59 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.47 14.59 82.33 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.766 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -104.65 148.96 25.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.767 0.317 . . . . 0.0 110.548 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -82.62 142.82 31.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.874 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.458 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.3 m -134.3 158.87 42.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.224 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 30.7 t -101.38 98.81 9.78 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.724 178.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.458 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 95.3 Cg_exo -42.99 145.4 1.17 Allowed 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.491 2.127 . . . . 0.0 112.681 -178.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.486 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 15.4 mttt -82.67 147.8 56.38 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.057 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 13.8 Cg_exo -74.18 160.69 42.09 Favored 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 123.394 2.729 . . . . 0.0 112.713 -179.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.53 151.31 46.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.668 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.81 120.99 7.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.096 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -99.48 158.47 15.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.419 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.2 ttt -133.62 132.46 40.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.026 0.441 . . . . 0.0 111.477 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.583 ' CD2' HD11 ' A' ' 16' ' ' ILE . 96.6 m-85 -138.93 146.25 40.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.367 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.426 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 6.1 t -121.96 133.76 54.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.948 0.404 . . . . 0.0 111.282 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.654 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 3.3 m-85 -123.47 171.26 9.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.718 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -130.89 20.49 4.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.171 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.442 ' ND2' HG23 ' A' ' 96' ' ' VAL . 45.1 t-20 -152.1 113.98 4.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.812 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.453 ' NH2' ' HB2' ' A' ' 53' ' ' ALA . 17.6 mmm180 -55.62 -31.74 62.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.914 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.03 -55.05 14.03 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.043 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.442 HG23 ' ND2' ' A' ' 93' ' ' ASN . 57.6 t -59.06 -47.68 89.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.338 179.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.436 ' HG3' ' CD1' ' A' ' 91' ' ' PHE . 16.4 ttp -64.46 -29.45 70.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.96 179.091 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -65.6 -34.08 77.41 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.403 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.428 ' O ' ' HB ' ' A' ' 103' ' ' THR . 60.2 m-80 -69.15 -40.44 78.2 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.591 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.571 HD12 ' CG2' ' A' ' 16' ' ' ILE . 24.3 mm -65.56 -52.12 54.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.739 179.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.701 ' NZ ' ' HB3' ' A' ' 50' ' ' ALA . 1.0 OUTLIER -63.07 -28.28 69.98 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.85 179.794 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 40.7 mtm -78.78 -40.81 32.13 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.66 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.428 ' HB ' ' O ' ' A' ' 99' ' ' ASN . 0.6 OUTLIER -75.52 -36.71 60.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.896 -179.97 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.715 ' HA ' HD12 ' A' ' 107' ' ' ILE . 13.5 mt -62.24 -40.37 95.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.876 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.798 ' HA ' HD12 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -62.32 -27.66 69.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.949 179.77 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -69.39 -40.36 77.44 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.996 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.097 HD13 HD13 ' A' ' 42' ' ' LEU . 4.0 mt -65.58 -44.99 93.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.296 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.798 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.1 mt -59.7 -61.0 1.66 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.608 0 CA-C-O 121.692 0.758 . . . . 0.0 109.259 179.057 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.5 t -50.97 -28.96 10.99 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.301 -1.318 . . . . 0.0 110.906 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 53.5 mtt-85 -68.48 -33.75 74.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.06 0.457 . . . . 0.0 110.576 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -105.44 -1.2 25.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.892 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.401 ' N ' ' O ' ' A' ' 108' ' ' ILE . 0.7 OUTLIER . . . . . 0 C--N 1.331 -0.238 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.821 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.6 p . . . . . 0 C--O 1.233 0.188 0 CA-C-O 120.653 0.263 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.459 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 50.5 m80 65.74 35.76 6.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.094 0.473 . . . . 0.0 111.373 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.49 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 68.5 p -178.35 152.05 0.65 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.908 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.404 ' CA ' ' CG1' ' A' ' 96' ' ' VAL . . . 176.17 116.53 0.46 Allowed Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.139 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.633 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -46.77 104.35 0.05 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.146 0.498 . . . . 0.0 111.386 -179.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.682 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -119.26 152.4 36.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.753 -178.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.645 HG23 ' O ' ' A' ' 12' ' ' VAL . 0.9 OUTLIER -100.63 125.76 54.4 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.267 0 CA-C-O 121.09 0.471 . . . . 0.0 110.469 179.0 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.506 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 4.3 t80 -113.3 130.78 56.17 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.125 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 81.8 mt-10 55.88 35.0 24.63 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.046 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 42.9 mtpt 75.78 1.49 3.55 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.362 -179.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.645 ' O ' HG23 ' A' ' 8' ' ' ILE . 41.0 t -99.8 155.46 4.14 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.616 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.554 ' HA ' HG13 ' A' ' 8' ' ' ILE . 71.9 p -98.44 148.58 23.57 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.572 0.701 . . . . 0.0 112.643 -178.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.482 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.86 -179.58 46.91 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 114.595 -1.184 . . . . 0.0 110.344 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.633 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.69 142.15 20.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 117.613 0.707 . . . . 0.0 110.465 179.344 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.855 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.68 118.45 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.766 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.561 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.426 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -119.3 137.79 53.45 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.234 -178.565 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.721 HD12 ' CG2' ' A' ' 103' ' ' THR . 64.8 mt -110.66 140.11 31.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.094 -179.101 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 -132.27 111.63 11.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.08 -179.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -91.14 3.44 54.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.2 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -78.81 -17.23 56.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.883 0.373 . . . . 0.0 110.469 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.87 141.66 16.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.941 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.469 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.3 t -114.37 116.58 43.94 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.747 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.469 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 1.6 Cg_endo -81.33 142.62 56.22 Favored 'Cis proline' 0 C--N 1.347 0.489 0 C-N-CA 123.818 -1.326 . . . . 0.0 111.904 -0.068 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.06 141.59 3.17 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.054 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -135.77 167.12 21.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.102 0.477 . . . . 0.0 111.739 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.855 HD21 HG12 ' A' ' 16' ' ' ILE . 4.5 tt -121.26 129.84 53.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.582 179.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.7 m -117.34 126.82 53.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.225 0.536 . . . . 0.0 112.156 -178.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.485 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 58.8 t90 -100.62 128.3 46.72 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.895 178.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.6 tpt180 -124.98 116.94 22.95 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.783 0.325 . . . . 0.0 111.065 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.482 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 12.5 m -45.49 166.23 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.01 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.75 -41.63 64.93 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.517 0.675 . . . . 0.0 109.526 179.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -84.66 -20.0 31.99 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.006 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.39 33.6 11.49 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.41 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -100.7 -22.85 14.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.658 0.266 . . . . 0.0 111.446 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 4.5 mtmt -130.23 137.56 50.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.777 0.322 . . . . 0.0 111.025 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 14.6 p -139.16 132.31 38.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.059 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.506 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 62.1 t60 -131.38 145.94 52.05 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.045 0.45 . . . . 0.0 111.222 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 48.5 m -129.12 134.48 48.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.025 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.9 t -126.71 140.81 47.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.031 0.443 . . . . 0.0 111.447 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.633 HG22 HG23 ' A' ' 44' ' ' THR . 1.9 p -85.54 117.55 30.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 1.018 HD13 HD13 ' A' ' 107' ' ' ILE . 83.6 mt -75.39 -31.69 60.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.244 -0.434 . . . . 0.0 112.097 -178.552 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.446 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 10.9 t -53.95 -23.36 12.76 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -179.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.633 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -92.07 -21.24 20.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.716 0.293 . . . . 0.0 111.014 -179.736 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.86 HD12 ' HB3' ' A' ' 62' ' ' LEU . 36.4 mm -57.75 87.03 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.995 0.426 . . . . 0.0 111.067 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.416 ' N ' ' O ' ' A' ' 63' ' ' ILE . 21.8 t70 -64.77 -32.57 74.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.0 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.703 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 4.4 mmmt -142.67 149.7 39.22 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.055 0.455 . . . . 0.0 111.28 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.595 HD21 ' HG3' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -131.98 125.95 32.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.778 179.175 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -136.79 158.91 43.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.994 0.426 . . . . 0.0 111.431 -179.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 1.086 ' HB2' HD12 ' A' ' 60' ' ' LEU . . . -148.12 166.49 27.7 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.958 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.451 HG23 ' HB3' ' A' ' 59' ' ' MET . 81.4 p -75.65 148.33 82.49 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.823 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.82 149.59 86.56 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.587 2.191 . . . . 0.0 112.362 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.82 -36.38 83.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.176 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.6 t -59.96 -26.29 65.88 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.994 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 24.1 t -86.62 117.09 25.16 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.918 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -56.98 -18.62 14.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.539 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.4 mttp -83.95 127.88 34.16 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.945 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.416 ' HB3' ' O ' ' A' ' 91' ' ' PHE . 2.0 ttm -102.02 149.88 23.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.935 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.451 ' HB3' HG23 ' A' ' 51' ' ' THR . 0.0 OUTLIER 178.38 138.91 0.09 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.914 0.388 . . . . 0.0 111.269 179.652 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 1.086 HD12 ' HB2' ' A' ' 50' ' ' ALA . 7.6 tp -126.1 123.92 39.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.122 179.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 20.8 mmt85 -110.14 123.56 49.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.929 0.395 . . . . 0.0 111.72 -179.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.86 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -109.25 128.07 54.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.372 179.466 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.703 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -105.63 122.69 59.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.576 -0.283 . . . . 0.0 110.986 179.871 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.89 -129.27 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.464 -0.874 . . . . 0.0 111.843 179.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.3 mttp -130.13 155.08 46.79 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.629 0.252 . . . . 0.0 110.516 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.75 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.2 p -118.78 -164.01 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.928 0.395 . . . . 0.0 111.243 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.75 ' H ' HG22 ' A' ' 66' ' ' VAL . 21.1 t70 -178.94 75.66 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.186 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.496 ' HG3' HG23 ' A' ' 81' ' ' VAL . 55.7 mp0 -55.0 -22.49 15.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.446 -179.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 37.6 m -58.24 -18.34 25.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.127 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.2 -61.4 1.83 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.907 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp 62.96 94.4 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.94 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.6 mtt180 -97.15 141.49 30.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.984 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.419 ' HA ' ' HA ' ' A' ' 79' ' ' GLU . 55.8 mmtt -78.76 145.13 34.57 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.911 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.499 ' HB3' HG11 ' A' ' 80' ' ' VAL . 37.3 p30 -97.23 175.85 6.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.068 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -60.59 -19.68 58.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.333 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -87.08 7.48 27.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.512 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.78 13.7 80.4 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.738 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -111.01 145.42 38.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.825 0.345 . . . . 0.0 110.845 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.419 ' HA ' ' HA ' ' A' ' 73' ' ' LYS . 96.9 mt-10 -72.16 143.13 49.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.069 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.499 HG11 ' HB3' ' A' ' 74' ' ' ASP . 1.3 m -140.59 151.82 20.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.072 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.496 HG23 ' HG3' ' A' ' 68' ' ' GLU . 2.3 p -85.62 108.62 17.1 Favored Pre-proline 0 C--N 1.319 -0.745 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.62 178.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.462 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 46.0 Cg_exo -56.72 145.98 79.64 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.125 1.883 . . . . 0.0 112.257 -178.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.413 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 18.6 mtmt -83.12 148.12 55.62 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.034 0.445 . . . . 0.0 110.882 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 13.2 Cg_exo -74.28 158.71 44.64 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 C-N-CA 123.342 2.695 . . . . 0.0 112.695 -179.032 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.47 136.31 56.28 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.61 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 32.2 mtm105 -134.69 138.31 44.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.852 0.358 . . . . 0.0 111.214 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -118.15 157.03 27.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.358 179.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 8.5 ttt -133.58 120.48 20.79 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.95 0.405 . . . . 0.0 111.372 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.642 ' CE2' HD11 ' A' ' 16' ' ' ILE . 97.0 m-85 -126.24 133.05 51.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.574 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -106.09 133.63 50.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.885 0.374 . . . . 0.0 111.147 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.682 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 2.5 m-85 -122.74 170.45 10.05 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.575 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -121.57 -22.83 5.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.801 0.334 . . . . 0.0 111.304 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -108.1 100.2 9.56 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.38 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -47.8 -30.16 3.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.111 0.481 . . . . 0.0 111.111 -179.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.45 -47.58 54.82 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.227 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.404 ' CG1' ' CA ' ' A' ' 5' ' ' GLY . 57.5 t -61.31 -50.22 81.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.395 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.829 ' HE3' ' HB1' ' A' ' 50' ' ' ALA . 41.8 ttp -62.49 -29.61 70.67 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -60.31 -34.49 73.86 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 121.098 0.475 . . . . 0.0 109.953 179.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -71.56 -33.68 69.31 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.891 178.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.508 HG21 HD22 ' A' ' 60' ' ' LEU . 19.6 mm -61.8 -47.83 91.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.586 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.651 ' HD3' ' HB3' ' A' ' 50' ' ' ALA . 13.4 mttt -67.47 -27.97 67.47 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.21 0.528 . . . . 0.0 110.357 179.354 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 77.5 mtp -78.55 -39.41 37.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.505 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.721 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -76.43 -40.54 50.39 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.714 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.743 ' HA ' HD12 ' A' ' 107' ' ' ILE . 18.9 mt -63.78 -36.83 85.19 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.85 0.357 . . . . 0.0 110.516 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.757 ' HA ' HD12 ' A' ' 108' ' ' ILE . 20.7 mt-30 -63.3 -29.37 70.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.973 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -68.98 -31.5 70.39 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.141 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.018 HD13 HD13 ' A' ' 42' ' ' LEU . 4.2 mt -76.49 -46.15 32.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.479 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.945 HG22 ' CD ' ' A' ' 112' ' ' LYS . 2.2 mt -57.1 -61.38 1.28 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.568 0 CA-C-O 121.746 0.784 . . . . 0.0 109.544 179.326 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 18.2 t -50.27 -28.84 8.4 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.396 -1.275 . . . . 0.0 110.462 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.36 -35.01 79.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.671 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -89.55 -31.28 17.69 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.869 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.945 ' CD ' HG22 ' A' ' 108' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.255 0 CA-C-O 120.956 0.408 . . . . 0.0 110.603 179.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.861 0.362 . . . . 0.0 111.019 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 79.4 m80 64.16 33.44 11.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.234 0.54 . . . . 0.0 110.981 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.615 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 53.0 p 179.33 174.62 0.75 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.62 179.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.409 ' HA3' HG13 ' A' ' 96' ' ' VAL . . . 153.53 120.03 0.77 Allowed Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.466 -0.874 . . . . 0.0 112.522 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.628 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -47.21 105.76 0.07 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.151 0.501 . . . . 0.0 111.34 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.759 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -120.49 151.52 39.25 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.761 -178.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.567 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -99.67 124.26 52.94 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.256 0 CA-C-O 121.014 0.435 . . . . 0.0 110.29 179.046 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.495 ' CZ ' ' CD2' ' A' ' 38' ' ' HIS . 16.9 t80 -112.7 130.38 56.08 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.112 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.42 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 83.4 mt-10 56.4 34.21 23.79 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.037 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.0 mttm 76.24 1.35 3.39 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.249 -179.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.529 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.6 t -99.71 154.42 4.26 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.671 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 178.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.567 ' HA ' HG13 ' A' ' 8' ' ' ILE . 78.0 p -97.31 148.47 23.1 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-O 121.604 0.716 . . . . 0.0 112.546 -178.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.462 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.59 -179.72 46.61 Favored Glycine 0 N--CA 1.447 -0.627 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.397 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.628 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.66 142.2 20.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 117.74 0.77 . . . . 0.0 110.521 179.369 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.706 HD11 ' CE2' ' A' ' 89' ' ' PHE . 0.1 OUTLIER -106.69 118.56 54.64 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.758 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 179.557 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.499 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -121.3 134.46 55.15 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.315 -178.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.533 HD12 ' CG2' ' A' ' 103' ' ' THR . 96.7 mt -111.04 140.09 31.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.194 -179.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -128.72 112.65 14.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.004 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -87.36 6.16 34.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.267 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -78.34 -18.31 55.34 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.912 0.387 . . . . 0.0 110.411 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -100.39 146.76 8.57 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.859 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.401 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.5 t -121.51 115.5 31.07 Favored Pre-proline 0 CA--C 1.532 0.269 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.957 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.433 ' HB3' ' CB ' ' A' ' 43' ' ' SER . 5.6 Cg_exo -77.67 145.28 79.06 Favored 'Cis proline' 0 C--N 1.348 0.501 0 C-N-CA 123.633 -1.403 . . . . 0.0 111.842 -0.078 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.678 ' O ' HD22 ' A' ' 42' ' ' LEU . . . -44.15 140.81 1.98 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.818 0.342 . . . . 0.0 110.916 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -124.69 157.72 34.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.132 0.491 . . . . 0.0 111.716 -179.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.694 ' HB2' HD11 ' A' ' 42' ' ' LEU . 4.4 tt -121.28 128.9 52.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.494 179.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.9 m -119.63 125.79 49.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.143 0.496 . . . . 0.0 112.168 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.489 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 60.2 t90 -100.49 127.79 46.74 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.727 178.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 44.8 ttp85 -122.0 117.15 25.68 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.798 0.333 . . . . 0.0 111.013 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.462 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 64.0 m -46.66 162.93 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.913 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.83 -41.57 68.0 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.536 0.684 . . . . 0.0 109.551 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -82.14 -21.14 36.78 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.803 -1.09 . . . . 0.0 111.044 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.09 34.48 12.64 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.329 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 51.9 t0 -104.0 -19.4 14.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.615 0.245 . . . . 0.0 111.614 -179.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.57 142.17 45.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.888 0.375 . . . . 0.0 111.327 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 48.6 t -139.26 138.05 40.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.925 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.495 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 50.9 t60 -134.55 145.77 49.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.207 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.449 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 43.5 m -129.31 134.86 48.12 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.175 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 90.8 t -135.04 139.69 46.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 CA-C-O 121.127 0.489 . . . . 0.0 111.836 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.565 HG22 HG23 ' A' ' 44' ' ' THR . 1.6 p -88.63 117.46 32.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.505 177.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.766 ' H ' HD22 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -73.95 -28.28 61.43 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -179.035 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.433 ' CB ' ' HB3' ' A' ' 24' ' ' PRO . 11.9 t -55.96 -21.59 21.77 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.157 0.429 . . . . 0.0 112.157 -179.161 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.565 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -96.54 -21.9 17.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.833 0.349 . . . . 0.0 111.413 -179.446 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.918 HD12 ' HB3' ' A' ' 62' ' ' LEU . 47.6 mm -53.18 94.19 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.028 0.442 . . . . 0.0 111.053 -179.751 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -61.15 -28.87 69.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.393 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.615 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 16.3 mttm -153.41 162.92 40.78 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.167 0.508 . . . . 0.0 111.603 -179.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.796 HD11 ' HB3' ' A' ' 104' ' ' LEU . 22.2 mt -123.88 124.36 42.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.362 179.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -111.07 130.34 55.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.621 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.585 ' HB3' ' NZ ' ' A' ' 101' ' ' LYS . . . -145.81 138.84 25.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.218 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.547 HG21 ' HB3' ' A' ' 57' ' ' LYS . 57.2 p -75.75 122.05 86.29 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.496 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -62.6 160.54 31.83 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.563 2.175 . . . . 0.0 112.49 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.92 -43.14 91.06 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.131 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.2 m -60.85 -27.71 68.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.06 0.457 . . . . 0.0 110.63 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 26.3 t -79.48 122.03 25.93 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.97 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -56.61 -18.74 13.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.284 179.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.547 ' HB3' HG21 ' A' ' 51' ' ' THR . 12.1 mptt -65.46 151.83 45.4 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.72 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.514 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 48.5 mtp -143.0 79.82 1.66 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.98 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -155.71 169.02 25.32 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.016 0.436 . . . . 0.0 111.569 -179.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.682 HD23 HD11 ' A' ' 62' ' ' LEU . 0.4 OUTLIER -135.85 126.82 27.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.147 179.554 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 32.8 mtp180 -119.06 129.9 55.34 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.93 0.395 . . . . 0.0 111.657 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.918 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -106.1 141.81 36.85 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.397 179.613 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.615 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.1 mm -105.15 112.84 40.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.687 0.279 . . . . 0.0 111.326 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -83.82 125.36 7.03 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.605 -0.807 . . . . 0.0 112.36 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 50.6 mttt -49.46 153.6 1.07 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.826 0.346 . . . . 0.0 111.185 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.718 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.3 p -117.65 -161.9 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.061 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.718 ' H ' HG22 ' A' ' 66' ' ' VAL . 23.5 m-20 -167.37 62.21 0.08 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.496 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -49.58 -28.27 5.47 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.402 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 36.9 m -54.44 -18.83 4.66 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.118 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.7 mmtp -62.44 -37.3 85.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.858 0.361 . . . . 0.0 110.988 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.6 mptt 61.37 93.48 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.864 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 -104.72 157.3 17.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.861 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -111.27 145.5 38.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.896 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.405 ' HB3' HG11 ' A' ' 80' ' ' VAL . 35.7 p30 -93.07 174.45 7.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.987 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -62.14 -18.36 60.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.393 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -86.95 7.98 25.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.556 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.93 11.25 81.23 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.718 -0.754 . . . . 0.0 112.694 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -106.55 146.09 31.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.844 0.354 . . . . 0.0 110.709 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -73.77 148.83 42.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.971 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.477 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.4 m -136.11 159.05 38.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.982 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.9 t -100.54 98.74 8.54 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.701 178.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.477 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 79.8 Cg_exo -44.17 145.13 2.42 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.402 2.068 . . . . 0.0 112.789 -179.085 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.439 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 8.6 mtmt -95.11 151.05 38.53 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.879 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 18.0 Cg_exo -71.4 143.43 43.14 Favored 'Trans proline' 0 N--CA 1.465 -0.198 0 C-N-CA 123.48 2.786 . . . . 0.0 112.746 -178.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.1 mm-40 -65.37 151.47 46.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.02 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 90.5 mtt180 -148.79 119.78 7.68 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.565 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -98.71 150.88 21.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.759 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -128.47 122.23 30.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.13 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.706 ' CE2' HD11 ' A' ' 16' ' ' ILE . 93.2 m-85 -127.2 155.1 43.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.604 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 35.7 t -129.35 134.96 48.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.906 0.384 . . . . 0.0 110.953 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.759 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 3.0 m-85 -127.48 147.99 50.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.685 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.514 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 47.6 m-20 -95.33 -24.03 16.92 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.242 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.493 ' HB2' HG23 ' A' ' 96' ' ' VAL . 92.6 m-20 -106.59 115.53 30.35 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.806 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -57.29 -31.28 65.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.936 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.02 -45.06 90.58 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.233 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.493 HG23 ' HB2' ' A' ' 93' ' ' ASN . 57.4 t -58.24 -44.19 87.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.754 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.438 ' HG2' ' CG ' ' A' ' 91' ' ' PHE . 3.2 mtm -60.72 -32.24 71.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.316 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.517 ' O ' ' HE2' ' A' ' 102' ' ' MET . 48.8 t0 -64.06 -29.98 71.09 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.881 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -80.89 -50.17 10.1 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.02 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.527 HD12 ' CG2' ' A' ' 16' ' ' ILE . 23.5 mm -58.68 -52.26 62.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.005 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.585 ' NZ ' ' HB3' ' A' ' 50' ' ' ALA . 2.2 ttmt -61.16 -32.08 71.81 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.952 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.517 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 33.4 mtm -78.86 -40.36 32.76 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.166 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.533 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -72.16 -41.32 67.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.275 -179.552 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.796 ' HB3' HD11 ' A' ' 48' ' ' LEU . 12.5 mt -64.05 -38.42 91.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.789 0.328 . . . . 0.0 110.775 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.772 ' HA ' HD12 ' A' ' 108' ' ' ILE . 2.2 mt-30 -65.61 -28.81 69.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.764 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -68.52 -35.94 78.16 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.673 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.746 HD13 HD23 ' A' ' 42' ' ' LEU . 57.8 mt -68.35 -46.7 80.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.081 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.772 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.2 mt -59.02 -61.12 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.508 -0.637 0 CA-C-O 121.809 0.814 . . . . 0.0 109.218 179.099 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 8.5 t -50.53 -28.72 9.07 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.379 -1.282 . . . . 0.0 110.434 179.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.45 -48.94 68.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.412 0.625 . . . . 0.0 109.841 179.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.403 ' CE2' ' CB ' ' A' ' 43' ' ' SER . 39.4 m-85 -75.36 -28.99 59.77 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.291 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.48 ' HE2' HG22 ' A' ' 108' ' ' ILE . 11.4 mttm . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.662 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.1 m . . . . . 0 C--O 1.23 0.046 0 CA-C-O 120.892 0.377 . . . . 0.0 110.892 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.419 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 54.8 m80 -113.05 34.0 4.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.164 0.507 . . . . 0.0 111.046 -179.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.493 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 36.5 p -170.48 145.42 2.61 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.547 179.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -177.69 116.91 0.56 Allowed Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.375 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.63 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -45.65 105.15 0.06 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.094 0.473 . . . . 0.0 111.437 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.761 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -120.59 151.42 39.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.905 -178.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.555 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -100.3 124.55 53.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.998 0.428 . . . . 0.0 110.425 179.145 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.501 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 11.1 t80 -112.79 130.58 56.03 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.179 179.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 56.14 34.24 23.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.007 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 25.8 mttp 76.38 1.06 3.32 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.334 -179.061 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.541 ' O ' HG23 ' A' ' 8' ' ' ILE . 41.7 t -99.35 154.93 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.633 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 178.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.555 ' HA ' HG13 ' A' ' 8' ' ' ILE . 98.1 p -98.05 148.72 23.23 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-O 121.67 0.748 . . . . 0.0 112.794 -178.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.453 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 175.52 -179.79 46.51 Favored Glycine 0 N--CA 1.446 -0.672 0 CA-C-N 114.452 -1.249 . . . . 0.0 110.285 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.63 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.61 143.13 17.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 117.688 0.744 . . . . 0.0 110.403 179.372 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.827 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.58 118.26 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 CA-C-N 115.335 -0.848 . . . . 0.0 108.767 179.575 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -121.52 124.58 44.75 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.2 0.524 . . . . 0.0 111.389 -178.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.736 HG23 HD11 ' A' ' 42' ' ' LEU . 53.6 mt -94.52 140.03 17.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.903 -179.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -127.37 111.53 13.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.079 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -95.81 5.39 51.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.239 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -79.71 -17.4 53.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.962 0.41 . . . . 0.0 110.538 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -102.96 145.39 12.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.938 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.404 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 4.4 t -119.67 116.41 33.24 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.86 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.413 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 73.0 Cg_endo -77.81 144.44 76.5 Favored 'Cis proline' 0 C--N 1.348 0.552 0 C-N-CA 123.491 -1.462 . . . . 0.0 112.332 0.09 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.411 ' HB1' HD12 ' A' ' 42' ' ' LEU . . . -50.7 151.4 2.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.88 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -137.62 165.75 25.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.201 0.524 . . . . 0.0 111.838 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.827 HD21 HG12 ' A' ' 16' ' ' ILE . 5.8 tt -121.24 121.98 38.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.325 179.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 41.0 m -112.56 124.93 53.64 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.482 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 56.3 t90 -100.65 127.74 46.95 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.875 178.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.17 118.33 27.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.852 0.358 . . . . 0.0 111.195 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.424 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 25.5 t -46.04 167.76 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.047 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.46 -42.43 59.07 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.481 0.658 . . . . 0.0 109.677 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 89.7 m-20 -89.11 -17.02 30.1 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.771 -1.104 . . . . 0.0 111.109 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.94 33.35 11.09 Favored Glycine 0 C--N 1.332 0.359 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.362 -179.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -95.46 -22.15 17.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.594 0.235 . . . . 0.0 111.492 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.6 143.08 37.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.826 0.346 . . . . 0.0 111.365 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 14.5 p -139.24 137.62 41.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.893 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.501 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 30.2 t60 -131.28 145.64 51.97 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.97 0.414 . . . . 0.0 111.218 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 40.9 m -129.09 136.03 49.69 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.959 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.694 ' CG1' HD11 ' A' ' 45' ' ' ILE . 77.5 t -130.07 141.73 45.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.235 0.54 . . . . 0.0 111.788 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.713 ' HB ' HG23 ' A' ' 44' ' ' THR . 0.0 OUTLIER -85.31 118.11 31.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.649 178.029 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 1.001 HD13 HD13 ' A' ' 107' ' ' ILE . 27.6 mt -66.89 -19.55 65.75 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.804 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.413 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 6.5 t -67.76 -25.43 65.62 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.799 179.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.713 HG23 ' HB ' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -87.1 -37.68 17.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.825 179.864 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.857 HG23 ' HB2' ' A' ' 62' ' ' LEU . 8.9 mm -58.31 87.99 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.492 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -83.96 -25.53 29.97 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.77 -178.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.559 ' HB2' HG12 ' A' ' 63' ' ' ILE . 13.6 mttp -125.17 158.0 35.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.21 0.529 . . . . 0.0 111.902 -179.098 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.854 HD12 ' HG3' ' A' ' 105' ' ' GLN . 28.8 mt -131.44 128.84 40.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.556 179.168 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.419 ' N ' ' O ' ' A' ' 61' ' ' ARG . 35.8 tt0 -129.54 130.38 45.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.885 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.458 ' HB2' ' CD1' ' A' ' 60' ' ' LEU . . . -143.51 137.66 28.65 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.019 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.469 ' O ' ' HE1' ' A' ' 97' ' ' MET . 31.6 p -75.67 126.24 87.53 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.8 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.43 160.74 46.44 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.509 2.139 . . . . 0.0 112.449 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.801 ' HB2' ' NH1' ' A' ' 94' ' ' ARG . . . -56.96 -42.95 81.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.11 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.0 m -61.5 -27.64 68.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.052 0.453 . . . . 0.0 110.697 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.3 m -77.48 121.68 24.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.879 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -56.22 -18.82 11.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.322 179.122 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.54 140.88 42.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.774 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 33.3 mtp -130.89 79.92 1.92 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.737 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -150.83 168.75 23.49 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.135 0.493 . . . . 0.0 111.579 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.458 ' CD1' ' HB2' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -137.84 123.78 20.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.973 179.474 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.419 ' O ' ' N ' ' A' ' 49' ' ' GLN . 40.4 ttt180 -127.93 136.78 51.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.795 0.331 . . . . 0.0 111.689 -179.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.857 ' HB2' HG23 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -119.41 144.09 47.12 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.443 179.227 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.688 ' N ' HD13 ' A' ' 63' ' ' ILE . 1.1 mm -101.08 134.23 41.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.827 0.346 . . . . 0.0 110.986 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -82.73 153.22 31.13 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.186 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.432 ' N ' ' O ' ' A' ' 44' ' ' THR . 38.4 mttt -60.12 163.13 5.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.709 0.29 . . . . 0.0 110.735 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.79 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.4 p -116.9 -163.43 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 121.018 0.437 . . . . 0.0 111.279 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.79 ' H ' HG22 ' A' ' 66' ' ' VAL . 56.0 m-20 -160.59 71.14 0.43 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.092 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.421 ' HG2' HG13 ' A' ' 81' ' ' VAL . 96.6 mt-10 -55.51 -20.9 14.36 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.534 -179.251 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 31.0 m -53.71 -21.69 7.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.797 0.332 . . . . 0.0 111.124 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.8 mtmm -76.32 -48.71 19.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.965 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 60.66 92.83 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.949 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 10.9 mtm180 -94.48 129.25 41.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.824 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 79' ' ' GLU . 29.1 mmtp -81.21 145.3 31.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.045 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -92.65 179.83 5.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.955 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -64.93 -18.84 65.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.333 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -87.82 -2.84 58.87 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.274 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.69 8.23 73.77 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.699 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 22.7 p30 -105.58 145.99 30.24 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.883 0.373 . . . . 0.0 110.93 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.421 ' HA ' ' HA ' ' A' ' 73' ' ' LYS . 49.5 mt-10 -71.83 143.78 49.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.92 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.444 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.8 m -138.86 158.77 30.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.165 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.421 HG13 ' HG2' ' A' ' 68' ' ' GLU . 37.4 t -83.88 110.22 24.01 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.444 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 88.3 Cg_exo -46.8 169.67 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.217 1.944 . . . . 0.0 112.758 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.498 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.1 OUTLIER -90.4 95.88 0.81 Allowed Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.215 -179.873 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.498 ' HD2' ' HA ' ' A' ' 83' ' ' LYS . 7.9 Cg_endo -46.53 161.45 0.18 Allowed 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 123.41 2.74 . . . . 0.0 112.363 179.289 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -65.48 159.92 23.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.655 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.641 ' HG2' HD12 ' A' ' 63' ' ' ILE . 6.2 mtp180 -155.23 133.15 11.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.24 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -118.52 133.3 55.98 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.314 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 22.7 ttt -113.95 137.29 51.88 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.986 0.422 . . . . 0.0 111.47 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.478 ' CE1' HD11 ' A' ' 16' ' ' ILE . 99.0 m-85 -139.27 151.22 46.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.486 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -123.27 135.24 54.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.893 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.761 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 2.8 m-85 -128.42 160.31 32.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.951 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 68.4 m-20 -110.64 9.96 22.89 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.277 179.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -141.64 107.75 5.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.636 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.801 ' NH1' ' HB2' ' A' ' 53' ' ' ALA . 1.9 tmm_? -49.02 -30.28 5.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.272 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.56 -55.11 6.73 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.451 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 56.4 t -55.39 -48.17 77.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.873 0.368 . . . . 0.0 110.707 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.469 ' HE1' ' O ' ' A' ' 51' ' ' THR . 15.4 ptm -63.82 -38.03 89.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.917 179.148 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -61.47 -34.36 75.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.365 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.431 ' O ' ' HB ' ' A' ' 103' ' ' THR . 81.6 m-20 -66.92 -41.45 87.06 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.631 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.594 HD12 ' CG2' ' A' ' 16' ' ' ILE . 27.2 mm -60.69 -52.37 62.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.853 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.633 ' O ' HD13 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -67.16 -27.87 67.65 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.254 179.534 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 39.7 mtm -78.11 -36.89 47.43 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.72 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.448 HG22 HD13 ' A' ' 18' ' ' ILE . 0.5 OUTLIER -79.47 -39.85 31.21 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.497 179.815 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.704 ' CD2' HD22 ' A' ' 42' ' ' LEU . 28.1 mt -59.99 -35.69 75.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.764 179.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.854 ' HG3' HD12 ' A' ' 48' ' ' LEU . 1.9 mt-30 -61.39 -32.18 72.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.796 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -65.64 -28.17 68.91 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.076 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.001 HD13 HD13 ' A' ' 42' ' ' LEU . 3.1 mt -81.11 -44.14 20.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.634 -179.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.659 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.2 mt -58.19 -61.35 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.585 0 CA-C-O 121.603 0.716 . . . . 0.0 109.444 179.402 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.7 p -49.08 -31.14 7.37 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.48 -1.236 . . . . 0.0 110.366 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -61.78 -41.8 98.18 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.568 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -85.3 -29.07 24.85 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.428 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.425 ' HE2' HG22 ' A' ' 108' ' ' ILE . 11.6 mttm . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.524 179.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.527 0.086 0 CA-C-O 120.901 0.382 . . . . 0.0 111.08 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 75.6 m80 63.93 31.9 13.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.195 0.521 . . . . 0.0 111.042 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.631 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 88.4 p 178.15 172.7 0.66 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.744 178.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.407 ' CA ' ' CG1' ' A' ' 96' ' ' VAL . . . 154.64 116.32 0.57 Allowed Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.746 -0.74 . . . . 0.0 111.966 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.583 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -40.39 117.56 0.82 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.846 0.355 . . . . 0.0 111.144 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.669 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -132.67 149.7 52.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.844 -178.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.596 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.1 mp -97.46 124.2 50.25 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 CA-C-O 121.023 0.44 . . . . 0.0 110.528 179.282 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.506 ' CD1' ' CE2' ' A' ' 89' ' ' PHE . 10.1 t80 -115.8 129.4 56.42 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.927 179.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 58.71 33.91 23.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.794 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.0 mttp 75.63 1.64 3.62 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.142 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.542 HG21 ' NZ ' ' A' ' 36' ' ' LYS . 32.7 t -100.94 151.42 5.34 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.694 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.596 ' HA ' HG13 ' A' ' 8' ' ' ILE . 85.3 p -90.36 145.89 24.6 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 121.435 0.636 . . . . 0.0 111.678 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.438 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -176.64 -179.22 46.96 Favored Glycine 0 N--CA 1.444 -0.817 0 CA-C-N 114.979 -1.009 . . . . 0.0 111.691 -179.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.583 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.9 mm -105.61 137.52 35.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 121.034 0.445 . . . . 0.0 110.194 179.667 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.753 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.1 OUTLIER -106.54 117.92 53.24 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.672 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.564 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -124.4 131.07 53.5 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.366 -177.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.766 HG23 HD11 ' A' ' 42' ' ' LEU . 89.0 mt -106.45 140.04 25.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.27 -179.261 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -132.25 112.49 12.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.971 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -90.95 6.14 45.85 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.215 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -79.44 -17.53 54.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.872 0.368 . . . . 0.0 110.529 179.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -100.2 143.27 14.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.972 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.445 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.9 t -115.15 116.26 42.36 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.821 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.445 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 1.8 Cg_endo -80.52 143.64 64.55 Favored 'Cis proline' 0 C--N 1.349 0.576 0 C-N-CA 123.701 -1.374 . . . . 0.0 111.928 -0.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.21 141.3 4.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.732 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 68.4 mt-10 -134.5 166.24 23.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.172 0.51 . . . . 0.0 111.877 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.677 HD21 HG12 ' A' ' 16' ' ' ILE . 5.5 tt -121.33 127.58 51.43 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.555 179.32 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 41.0 m -116.6 129.61 56.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.212 0.53 . . . . 0.0 112.13 -178.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.496 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 56.3 t90 -100.47 125.69 46.81 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.984 178.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -122.61 117.3 25.52 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.71 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.412 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 30.3 t -44.48 158.96 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.752 0.311 . . . . 0.0 110.88 -179.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.438 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -66.42 -39.48 88.97 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 121.616 0.722 . . . . 0.0 109.352 179.9 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 42.8 p30 -89.46 -18.93 25.78 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.296 179.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.04 32.0 11.3 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.672 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -99.29 -18.88 17.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.725 0.297 . . . . 0.0 111.467 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.542 ' NZ ' HG21 ' A' ' 12' ' ' VAL . 8.8 mtmt -134.97 140.6 45.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.089 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.2 t -139.11 137.09 42.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.897 0.38 . . . . 0.0 111.294 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.506 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 82.5 t60 -137.7 146.3 43.6 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.088 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 47.8 m -129.07 138.0 51.6 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.216 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.5 t -132.15 140.87 46.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 121.095 0.474 . . . . 0.0 111.421 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.574 HG22 HG23 ' A' ' 44' ' ' THR . 2.3 p -86.02 117.84 31.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.051 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 1.055 HD13 HD13 ' A' ' 107' ' ' ILE . 78.7 mt -75.47 -31.2 60.17 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.095 0.405 . . . . 0.0 112.095 -178.539 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.421 ' HB3' ' HB3' ' A' ' 24' ' ' PRO . 58.3 p -55.63 -21.86 19.81 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.122 0.415 . . . . 0.0 112.122 -178.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.574 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -96.28 -21.84 17.59 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.756 0.312 . . . . 0.0 111.271 -179.785 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.606 HD12 ' HB3' ' A' ' 62' ' ' LEU . 38.0 mm -50.19 95.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.059 0.457 . . . . 0.0 111.039 -179.755 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -67.68 -27.94 67.26 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.317 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.602 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 38.4 mttm -156.72 159.89 38.79 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.045 0.45 . . . . 0.0 111.569 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.578 HD23 ' HG3' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -131.73 128.16 38.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.777 179.357 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.787 ' O ' HD23 ' A' ' 60' ' ' LEU . 93.0 mt-30 -119.59 141.02 49.65 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.937 0.399 . . . . 0.0 111.071 -179.363 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.85 143.25 31.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.992 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.693 HG23 ' O ' ' A' ' 59' ' ' MET . 43.0 p -75.7 111.21 13.33 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.597 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -64.56 160.59 39.09 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.559 2.173 . . . . 0.0 112.621 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.21 -41.84 72.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.186 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.0 m -58.12 -27.54 63.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.115 0.484 . . . . 0.0 110.788 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 31.4 t -86.29 118.65 25.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.817 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -57.18 -18.36 15.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.476 179.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -72.95 145.64 46.62 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.061 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 59.1 mtp -129.9 95.13 3.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.583 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.693 ' O ' HG23 ' A' ' 51' ' ' THR . 3.1 tmm? -175.36 148.65 0.96 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.053 0.454 . . . . 0.0 111.266 -179.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.787 HD23 ' O ' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -114.32 145.7 41.45 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.368 179.694 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.1 mtt-85 -130.88 131.68 44.68 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.004 0.43 . . . . 0.0 111.726 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.606 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -111.48 142.06 44.25 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.361 179.41 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.602 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.6 mm -103.51 150.17 7.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.746 0.308 . . . . 0.0 110.8 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -114.32 134.72 11.92 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.234 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 19.8 mttt -54.33 147.07 14.17 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.75 0.31 . . . . 0.0 110.877 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.739 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.2 p -115.0 -162.98 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.346 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.739 ' H ' HG22 ' A' ' 66' ' ' VAL . 52.1 t0 -178.69 76.58 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.102 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.467 ' OE2' HG11 ' A' ' 81' ' ' VAL . 48.1 mt-10 -53.71 -23.83 12.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.424 -179.393 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 42.3 m -61.93 -15.39 42.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.104 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.5 mmtp -64.02 -45.09 90.48 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.753 0.311 . . . . 0.0 111.067 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.9 mmtt 64.09 95.83 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.893 0.377 . . . . 0.0 110.79 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 26.1 mmt85 -106.54 146.99 29.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.849 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -104.04 145.16 30.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.966 0.413 . . . . 0.0 110.969 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 43.6 p30 -87.6 176.91 7.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.991 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -65.1 -16.97 64.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.357 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -86.43 6.66 29.22 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.518 -179.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.16 9.65 86.68 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.759 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.2 m-80 -101.31 161.15 13.83 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.763 0.316 . . . . 0.0 110.775 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -90.51 150.42 21.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.887 0.375 . . . . 0.0 110.927 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.469 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.7 m -140.5 158.72 24.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.167 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.467 HG11 ' OE2' ' A' ' 68' ' ' GLU . 20.4 t -86.72 108.89 20.16 Favored Pre-proline 0 C--N 1.326 -0.45 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 178.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.469 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 78.2 Cg_exo -50.23 145.29 20.94 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.111 1.874 . . . . 0.0 112.466 -178.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.466 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 7.4 mtpt -110.66 151.56 42.9 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.054 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 15.1 Cg_exo -73.41 155.03 50.98 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 C-N-CA 123.589 2.859 . . . . 0.0 112.642 -178.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -87.13 155.35 20.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.413 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 18.4 ttp180 -141.79 119.72 11.97 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.749 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 13.0 m-70 -94.64 136.33 35.06 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.221 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -120.48 112.14 18.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.914 0.388 . . . . 0.0 111.541 -179.5 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.753 ' CD2' HD11 ' A' ' 16' ' ' ILE . 86.4 m-85 -118.12 125.19 49.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.156 179.16 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -95.06 128.8 42.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.968 0.413 . . . . 0.0 111.236 -179.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.669 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 75.2 m-85 -113.44 145.55 40.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.81 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -107.75 25.3 11.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.911 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.52 ' HB3' HG23 ' A' ' 96' ' ' VAL . 1.5 t30 -151.91 108.6 3.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.519 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 24.3 mtm-85 -52.0 -29.38 20.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.231 -179.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.12 -54.99 5.83 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.464 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.52 HG23 ' HB3' ' A' ' 93' ' ' ASN . 46.0 t -54.25 -47.14 68.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.813 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.5 ' HB2' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -61.39 -34.36 75.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.964 0.412 . . . . 0.0 110.21 179.337 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.427 ' O ' ' HB3' ' A' ' 102' ' ' MET . 50.6 t0 -63.63 -33.61 76.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.78 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 38.2 m-80 -67.45 -36.96 82.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.168 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.525 HD12 ' CG2' ' A' ' 16' ' ' ILE . 22.8 mm -66.31 -49.22 77.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.739 179.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.525 ' HB2' HD11 ' A' ' 48' ' ' LEU . 0.3 OUTLIER -65.27 -27.52 68.69 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.726 179.989 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.427 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -78.71 -40.91 32.36 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.165 179.654 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.437 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -74.23 -39.6 62.96 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.755 -179.898 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.71 ' HA ' HD12 ' A' ' 107' ' ' ILE . 13.2 mt -62.01 -41.03 97.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.714 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.77 ' HA ' HD12 ' A' ' 108' ' ' ILE . 6.1 mt-30 -62.95 -27.28 69.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.994 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -70.47 -32.01 69.37 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.96 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.055 HD13 HD13 ' A' ' 42' ' ' LEU . 5.8 mt -75.93 -46.19 35.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.504 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.77 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.0 mt -56.67 -61.34 1.25 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.585 0 CA-C-O 121.742 0.782 . . . . 0.0 109.635 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 11.5 t -51.0 -28.8 10.74 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.43 -1.259 . . . . 0.0 110.373 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.37 -40.13 95.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.344 179.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -84.14 -29.81 26.39 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.28 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.487 ' HE2' HG22 ' A' ' 108' ' ' ILE . 9.7 mttm . . . . . 0 C--N 1.332 -0.193 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.496 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.5 p . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.691 0.282 . . . . 0.0 111.377 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.422 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 74.5 m80 -153.03 36.0 0.48 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.154 0.502 . . . . 0.0 110.917 -179.71 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.476 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 11.7 p -175.04 134.21 0.33 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.649 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -162.2 119.29 0.87 Allowed Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.417 179.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.648 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -43.86 106.12 0.06 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.204 0.526 . . . . 0.0 111.298 -179.612 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.741 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -120.15 152.08 38.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.916 -178.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.541 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -100.1 124.79 53.78 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.252 0 CA-C-O 120.959 0.409 . . . . 0.0 110.241 178.876 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.507 ' HB3' ' CZ3' ' A' ' 29' ' ' TRP . 27.3 t80 -112.25 130.43 55.93 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.19 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.427 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 88.9 mt-10 55.24 34.83 23.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.906 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.9 mtpt 76.1 1.3 3.43 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.353 -179.096 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.528 ' O ' HG23 ' A' ' 8' ' ' ILE . 41.4 t -99.38 154.98 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.643 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.541 ' HA ' HG13 ' A' ' 8' ' ' ILE . 90.4 p -96.65 148.96 22.33 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-O 121.562 0.696 . . . . 0.0 112.595 -178.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.447 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.31 -179.68 46.39 Favored Glycine 0 N--CA 1.445 -0.749 0 CA-C-N 114.569 -1.196 . . . . 0.0 110.181 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.648 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.9 143.19 18.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 117.632 0.716 . . . . 0.0 110.637 179.47 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.823 HG12 HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -106.76 118.63 54.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 179.571 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -119.03 129.13 54.95 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.168 0.508 . . . . 0.0 111.409 -178.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.48 HD12 ' CG2' ' A' ' 103' ' ' THR . 54.0 mt -102.9 140.07 22.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.934 -179.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 47.2 t-20 -132.48 111.42 11.26 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.913 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -93.23 4.64 53.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.247 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -78.95 -17.55 55.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.004 0.43 . . . . 0.0 110.437 179.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.64 140.75 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.92 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.443 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.5 t -112.94 116.93 46.93 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.767 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.443 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 1.1 Cg_endo -81.5 142.68 55.46 Favored 'Cis proline' 0 C--N 1.347 0.493 0 C-N-CA 123.878 -1.301 . . . . 0.0 112.054 0.082 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.58 142.85 5.53 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.88 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 72.9 mt-10 -136.03 167.19 21.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.126 0.489 . . . . 0.0 111.552 -179.58 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.823 HD21 HG12 ' A' ' 16' ' ' ILE . 5.3 tt -121.15 129.14 53.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.854 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.5 m -117.05 127.64 54.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.105 0.479 . . . . 0.0 112.011 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.507 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 57.0 t90 -100.57 130.05 46.58 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.111 179.151 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.5 ttt180 -124.97 116.29 21.93 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.938 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.447 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 10.6 m -45.45 163.85 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.042 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.88 -41.5 67.94 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 121.497 0.665 . . . . 0.0 109.551 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.2 t0 -83.3 -20.74 33.86 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.046 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.26 34.3 12.66 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.34 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -100.99 -21.24 15.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.572 0.225 . . . . 0.0 111.505 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.41 144.23 46.41 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.931 0.396 . . . . 0.0 111.329 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 11.7 p -139.4 137.76 40.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.011 179.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.498 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 13.6 t60 -132.31 145.53 51.34 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.859 0.361 . . . . 0.0 111.169 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 45.2 m -129.16 135.58 49.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.998 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.4 t -130.07 140.95 47.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.007 0.432 . . . . 0.0 111.642 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.51 ' CG1' HG23 ' A' ' 44' ' ' THR . 7.0 p -87.99 117.47 31.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.367 178.364 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.948 HD13 ' CD1' ' A' ' 107' ' ' ILE . 18.7 mt -76.02 -33.26 59.66 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -178.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.402 ' CB ' ' HB3' ' A' ' 24' ' ' PRO . 39.4 t -57.18 -19.69 22.16 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.51 HG23 ' CG1' ' A' ' 41' ' ' VAL . 0.2 OUTLIER -101.58 -22.45 14.48 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.346 -179.614 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.573 HD12 ' HB3' ' A' ' 62' ' ' LEU . 39.8 mm -47.87 95.19 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.047 0.451 . . . . 0.0 110.999 -179.673 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -66.73 -26.77 67.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.625 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.766 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 19.1 mttm -148.14 152.6 37.57 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.149 0.5 . . . . 0.0 111.942 -179.227 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.551 HD22 ' N ' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -133.95 128.53 34.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.613 179.178 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -133.58 152.83 51.97 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.067 0.46 . . . . 0.0 111.437 -179.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -148.08 153.19 38.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.729 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 37.4 p -75.8 118.82 73.88 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.548 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -64.1 159.11 44.4 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.491 2.127 . . . . 0.0 112.565 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.93 -41.52 98.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.087 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.7 t -57.92 -27.48 63.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.845 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.9 t -85.97 117.91 25.12 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.83 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -57.15 -18.28 14.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.532 179.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.0 mmtm -74.94 140.54 43.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.935 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.402 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 10.7 mmm -120.44 115.47 23.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.444 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.64 169.13 1.72 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.112 0.482 . . . . 0.0 111.839 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.419 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -145.73 134.07 21.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.982 179.519 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.2 mtt180 -125.45 133.1 52.57 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.072 0.463 . . . . 0.0 112.138 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.573 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -112.97 131.23 55.84 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.128 179.292 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.766 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.2 mm -99.75 149.99 5.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.77 0.319 . . . . 0.0 111.069 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -120.53 137.74 12.33 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.37 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 24.0 mttp -53.7 141.92 24.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.871 0.367 . . . . 0.0 111.118 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.759 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.4 p -119.57 -161.52 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.799 179.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.759 ' H ' HG22 ' A' ' 66' ' ' VAL . 23.8 t0 -165.76 58.94 0.11 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.399 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -57.78 -22.41 46.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.253 -179.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 40.8 m -61.24 -16.62 47.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.959 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.4 mtmt -74.45 -35.83 63.34 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.087 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.1 mttt 61.96 93.63 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.684 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 25.8 mmt85 -95.79 141.41 29.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.103 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 43.8 mmtt -89.9 145.64 24.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.956 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -93.07 172.21 8.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.839 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -60.32 -19.97 57.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.185 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -86.29 4.29 39.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.405 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.92 15.25 81.43 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.676 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -111.39 144.68 40.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.923 0.392 . . . . 0.0 110.967 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -70.73 148.99 47.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.038 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.46 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.4 m -134.17 158.94 42.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.03 179.815 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 33.6 t -100.23 98.99 8.54 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.103 -0.498 . . . . 0.0 109.781 178.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.46 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 85.3 Cg_exo -40.07 148.14 0.18 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.721 2.281 . . . . 0.0 113.034 -179.02 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.513 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -115.72 107.35 48.68 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.012 -179.938 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.58 ' HD3' HG21 ' A' ' 66' ' ' VAL . 1.8 Cg_endo -39.09 141.88 0.37 Allowed 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 123.543 2.829 . . . . 0.0 112.585 179.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 59.7 mm-40 -65.48 126.34 27.97 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.773 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -122.48 120.42 33.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.931 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.437 ' HB3' ' CE2' ' A' ' 89' ' ' PHE . 94.0 m-70 -98.57 139.23 34.6 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.578 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -121.53 107.86 12.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.256 -179.644 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.597 ' CD1' HD11 ' A' ' 16' ' ' ILE . 95.5 m-85 -114.94 125.43 53.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.462 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.02 136.15 35.69 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.019 0.437 . . . . 0.0 111.136 -179.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.741 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 92.5 m-85 -123.69 158.69 31.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.844 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.402 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 68.8 m-20 -115.56 -19.81 10.44 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.405 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.461 HD22 HG21 ' A' ' 96' ' ' VAL . 93.6 m-20 -107.33 114.64 28.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.797 179.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 9.8 mtt85 -57.83 -29.22 64.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.07 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -77.02 -55.15 5.71 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.361 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.461 HG21 HD22 ' A' ' 93' ' ' ASN . 44.6 t -56.85 -45.29 83.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.934 0.397 . . . . 0.0 110.675 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.411 ' HB3' ' CB ' ' A' ' 91' ' ' PHE . 3.9 ppp? -63.84 -36.81 85.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.053 179.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -62.52 -33.3 74.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.446 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -67.18 -33.73 76.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.987 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.543 HG22 HD12 ' A' ' 104' ' ' LEU . 17.5 mm -69.83 -48.71 62.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.642 179.346 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.428 ' HA ' HD11 ' A' ' 48' ' ' LEU . 8.5 ptpt -64.4 -27.72 69.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.849 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.7 -41.2 31.7 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.447 179.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.48 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -77.21 -30.85 54.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.691 179.876 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.682 ' CD2' HD22 ' A' ' 42' ' ' LEU . 13.5 mt -71.07 -38.63 72.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.788 179.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.722 ' HA ' HD12 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -68.4 -29.24 67.88 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.568 179.792 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -71.28 -33.59 69.89 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.709 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.948 ' CD1' HD13 ' A' ' 42' ' ' LEU . 16.3 mt -70.2 -47.96 64.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.016 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.935 HG22 ' CD ' ' A' ' 112' ' ' LYS . 2.7 mt -57.79 -61.07 1.46 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.631 0 CA-C-O 121.862 0.839 . . . . 0.0 109.224 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 27.3 m -50.2 -28.81 8.15 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.376 179.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -65.11 -35.31 80.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.785 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.4 ' CZ ' ' HB2' ' A' ' 43' ' ' SER . 69.1 m-85 -89.53 -31.09 17.79 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.04 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.935 ' CD ' HG22 ' A' ' 108' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.586 179.615 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.6 p . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.858 0.361 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.405 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 33.3 m80 65.15 32.97 9.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.229 0.537 . . . . 0.0 111.204 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.562 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 72.6 p 177.65 142.72 0.09 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.665 179.158 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -177.88 114.48 0.46 Allowed Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.327 179.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.649 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -44.72 100.12 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.204 0.526 . . . . 0.0 111.327 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.845 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -115.71 152.03 33.98 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.066 -178.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.567 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -97.7 124.04 50.45 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.193 178.922 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.523 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 18.7 t80 -112.03 130.31 55.91 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.186 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.425 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 38.9 mt-10 56.07 34.92 24.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.872 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 mtpm? 76.18 0.67 3.31 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.25 -178.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.526 ' O ' HG23 ' A' ' 8' ' ' ILE . 41.3 t -99.92 155.41 4.18 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.713 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.567 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -96.87 149.86 21.39 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 121.379 0.609 . . . . 0.0 112.48 -178.75 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.453 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 174.83 -179.76 45.93 Favored Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.511 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.649 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.96 141.11 22.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 117.68 0.74 . . . . 0.0 110.457 179.307 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.662 HD11 ' CE1' ' A' ' 89' ' ' PHE . 0.1 OUTLIER -106.71 118.31 54.2 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 CA-C-N 115.312 -0.858 . . . . 0.0 108.685 179.737 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.436 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -119.75 138.57 53.24 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.201 -178.605 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.515 HG21 HD11 ' A' ' 107' ' ' ILE . 96.4 mt -112.78 140.08 34.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.327 -178.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -127.08 114.01 17.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.903 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -86.86 5.85 34.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.279 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -79.36 -17.54 54.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.868 0.366 . . . . 0.0 110.426 179.375 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.02 152.0 5.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.984 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.425 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.2 t -129.73 114.74 17.94 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.883 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.425 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 57.5 Cg_endo -72.82 147.25 89.05 Favored 'Cis proline' 0 C--N 1.349 0.578 0 C-N-CA 123.296 -1.543 . . . . 0.0 111.955 0.121 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.713 ' O ' HD22 ' A' ' 42' ' ' LEU . . . -45.44 136.85 5.27 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.557 179.631 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -116.95 152.94 33.51 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.376 0.608 . . . . 0.0 112.03 -178.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.895 ' CB ' HD11 ' A' ' 42' ' ' LEU . 2.9 tt -121.3 130.6 53.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.147 179.166 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.9 m -120.52 127.33 52.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.159 0.504 . . . . 0.0 112.049 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.523 ' CH2' ' HB3' ' A' ' 9' ' ' PHE . 60.6 t90 -100.56 126.77 47.04 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.706 179.044 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 38.1 ttt180 -121.35 116.56 25.04 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.854 0.359 . . . . 0.0 110.875 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.466 ' HG ' ' H ' ' A' ' 36' ' ' LYS . 0.9 OUTLIER -45.48 166.92 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.083 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.87 -42.04 61.34 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 121.541 0.686 . . . . 0.0 109.702 179.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -82.69 -20.68 35.65 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.837 -1.074 . . . . 0.0 111.121 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.47 34.4 12.05 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.292 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -103.9 -19.71 14.15 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 -179.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.466 ' H ' ' HG ' ' A' ' 31' ' ' SER . 0.0 OUTLIER -135.06 144.04 47.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.892 0.377 . . . . 0.0 111.372 -179.855 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 47.5 t -139.52 140.04 37.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.037 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.498 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 80.8 t60 -134.33 146.22 49.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.052 179.704 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.439 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 46.4 m -129.15 135.91 49.49 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.337 -179.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 84.7 t -139.24 140.54 37.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 CA-C-O 121.066 0.46 . . . . 0.0 111.645 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.637 HG22 HG23 ' A' ' 44' ' ' THR . 1.9 p -88.31 117.6 32.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 177.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.895 HD11 ' CB ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -74.28 -35.91 63.76 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -178.277 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.401 ' CB ' ' HB2' ' A' ' 24' ' ' PRO . 8.3 m -50.04 -25.94 3.88 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -178.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.637 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -87.17 -23.52 24.78 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.167 -179.668 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.829 HD12 ' HB3' ' A' ' 62' ' ' LEU . 44.3 mm -50.05 96.66 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.129 0.49 . . . . 0.0 110.917 -179.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.423 ' N ' ' O ' ' A' ' 63' ' ' ILE . 16.7 t0 -72.44 -22.93 61.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.954 -179.232 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.452 ' HB2' HG13 ' A' ' 63' ' ' ILE . 43.4 mttm -157.27 137.91 13.12 Favored 'General case' 0 CA--C 1.522 -0.133 0 C-N-CA 120.422 -0.511 . . . . 0.0 111.949 -179.449 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.629 HD21 HD13 ' A' ' 104' ' ' LEU . 15.3 mt -106.34 124.04 48.99 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.903 178.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 91.9 mm-40 -115.51 133.26 56.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.801 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.428 ' HB2' HD11 ' A' ' 60' ' ' LEU . . . -142.99 146.34 33.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.057 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.676 HG23 ' O ' ' A' ' 59' ' ' MET . 74.9 p -75.63 130.56 78.94 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.687 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -67.02 160.21 48.35 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.49 2.127 . . . . 0.0 112.519 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.07 -42.87 95.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.02 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 87.1 p -60.63 -26.47 67.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.773 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.6 m -77.36 120.16 21.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.861 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -56.98 -18.1 12.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.409 179.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -67.28 155.96 37.57 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.956 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.418 ' HE1' ' O ' ' A' ' 92' ' ' ASN . 44.0 mtp -142.96 80.5 1.69 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.725 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.676 ' O ' HG23 ' A' ' 51' ' ' THR . 10.4 tmm? -162.35 149.37 13.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.453 -179.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.428 HD11 ' HB2' ' A' ' 50' ' ' ALA . 0.2 OUTLIER -116.35 152.98 32.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.479 179.771 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -137.91 135.41 36.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.995 0.426 . . . . 0.0 111.886 -179.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.829 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -103.53 144.24 31.68 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.384 179.501 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.452 HG13 ' HB2' ' A' ' 47' ' ' LYS . 1.2 mm -116.47 122.65 70.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.059 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.63 151.92 20.56 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.415 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.8 mttt -70.47 136.41 49.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.845 0.355 . . . . 0.0 111.001 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.488 ' CG2' ' N ' ' A' ' 67' ' ' ASP . 1.4 p -70.15 160.51 5.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.299 0.571 . . . . 0.0 111.312 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.488 ' N ' ' CG2' ' A' ' 66' ' ' VAL . 0.5 OUTLIER -113.18 130.69 56.13 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.784 179.901 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -95.0 3.63 54.71 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.453 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 24.0 t -72.08 -9.99 59.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.326 -179.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.71 -69.1 0.77 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.757 0.313 . . . . 0.0 111.176 -179.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.6 mmtt 62.47 94.23 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.788 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 16.6 mtt-85 -108.17 153.13 23.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.037 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.5 mmtp -93.28 147.73 22.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.986 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -90.47 176.71 6.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.005 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -63.75 -18.67 64.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.272 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -88.57 -5.89 57.9 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.344 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 91.88 9.52 62.4 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.711 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 -105.95 145.15 31.67 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.892 0.377 . . . . 0.0 110.965 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -72.3 144.08 48.48 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.915 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.44 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.3 m -132.3 158.82 43.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.175 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 32.5 t -101.5 98.8 9.95 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.678 178.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.44 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 99.2 Cg_exo -42.0 158.54 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.597 2.198 . . . . 0.0 112.743 -179.113 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.447 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.1 OUTLIER -69.86 149.96 96.51 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-O 121.115 0.483 . . . . 0.0 111.055 -179.874 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 16.8 Cg_exo -72.34 164.14 36.52 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 123.473 2.782 . . . . 0.0 112.622 -179.073 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 -65.55 157.36 29.93 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.692 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 62.3 mtm180 -150.11 119.82 7.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.799 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.433 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 36.2 m-70 -105.32 159.06 16.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.465 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -126.67 144.6 50.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.213 0.53 . . . . 0.0 111.681 -179.503 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.662 ' CE1' HD11 ' A' ' 16' ' ' ILE . 97.7 m-85 -157.51 125.21 5.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.119 179.406 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 22.6 t -109.36 139.86 43.79 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.899 0.381 . . . . 0.0 111.387 -179.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.845 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 0.8 OUTLIER -126.76 146.57 50.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.521 179.681 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.418 ' O ' ' HE1' ' A' ' 58' ' ' MET . 10.9 m120 -87.21 -18.04 31.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.312 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.461 ' HB2' HG23 ' A' ' 96' ' ' VAL . 94.8 m-20 -109.43 119.43 39.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.819 0.343 . . . . 0.0 110.741 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.62 -31.83 66.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.986 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.91 -46.73 73.92 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.168 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.461 HG23 ' HB2' ' A' ' 93' ' ' ASN . 48.3 t -59.86 -34.2 55.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.484 179.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.478 ' HG2' ' CG ' ' A' ' 91' ' ' PHE . 0.2 OUTLIER -63.59 -37.55 87.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.523 179.568 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -71.06 -36.61 72.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.86 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -60.22 -47.39 86.16 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.762 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.524 HG22 HD12 ' A' ' 104' ' ' LEU . 24.5 mm -65.46 -48.98 80.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.888 179.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.23 -27.61 68.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.898 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 44.6 mtm -78.65 -37.79 41.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.466 179.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.485 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -79.43 -38.97 33.49 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.744 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.629 HD13 HD21 ' A' ' 48' ' ' LEU . 30.2 mt -64.7 -39.62 93.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.591 179.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.593 ' HA ' HD12 ' A' ' 108' ' ' ILE . 48.3 mt-30 -61.92 -31.09 71.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.519 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -68.52 -35.45 77.49 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.666 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.664 HG21 ' HB2' ' A' ' 42' ' ' LEU . 58.2 mt -68.22 -48.49 73.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.957 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.807 HG22 ' HD3' ' A' ' 112' ' ' LYS . 2.7 mt -59.93 -61.07 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.508 -0.668 0 CA-C-O 121.663 0.744 . . . . 0.0 109.06 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.5 m -49.74 -28.94 6.81 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.248 -1.342 . . . . 0.0 110.81 179.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 31.3 mtt-85 -66.97 -34.8 78.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.707 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -96.41 -30.62 13.27 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.888 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.807 ' HD3' HG22 ' A' ' 108' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.626 179.693 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.0 m . . . . . 0 C--O 1.23 0.065 0 CA-C-O 120.714 0.292 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.412 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 78.0 m80 -137.9 34.02 2.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.174 0.511 . . . . 0.0 110.828 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.521 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 49.9 p 179.97 120.43 0.06 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.709 179.103 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.417 ' O ' ' C ' ' A' ' 6' ' ' ALA . . . -147.4 115.75 0.79 Allowed Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.781 -0.723 . . . . 0.0 111.963 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.554 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -34.2 118.68 0.39 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.794 0.33 . . . . 0.0 111.116 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.583 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -133.46 150.98 51.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.075 -178.734 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.613 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.4 mp -99.83 124.57 53.31 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 CA-C-O 121.157 0.503 . . . . 0.0 110.521 179.227 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.504 ' HB3' ' CZ3' ' A' ' 29' ' ' TRP . 18.2 t80 -116.62 132.53 56.66 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.033 179.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.426 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 89.7 mt-10 57.41 33.48 23.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.741 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.5 mttm 75.29 1.24 3.65 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.001 -178.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.483 ' O ' HG23 ' A' ' 8' ' ' ILE . 25.0 t -101.0 144.37 12.94 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.769 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.752 179.078 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.613 ' HA ' HG13 ' A' ' 8' ' ' ILE . 81.0 p -83.72 145.6 28.65 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.278 -179.568 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.442 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . -174.3 -179.12 44.71 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.844 -179.377 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.554 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 4.5 mm -105.37 135.27 44.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-O 120.914 0.388 . . . . 0.0 110.373 179.74 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.583 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.2 OUTLIER -106.44 118.01 53.3 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.884 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 178.634 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.459 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -122.08 128.69 51.63 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.345 0.593 . . . . 0.0 111.84 -177.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.412 ' O ' ' HB3' ' A' ' 3' ' ' HIS . 59.8 mt -101.77 140.01 21.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.787 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.461 ' ND2' HG21 ' A' ' 22' ' ' VAL . 50.2 p-10 -131.27 111.47 11.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.999 0.428 . . . . 0.0 111.168 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -92.4 4.01 54.29 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.419 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -78.35 -17.71 56.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.962 0.41 . . . . 0.0 110.414 179.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.461 HG21 ' ND2' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -100.88 151.32 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.015 -179.719 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.44 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.1 t -123.67 117.56 27.53 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.642 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.453 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 1.6 Cg_endo -79.74 145.65 73.81 Favored 'Cis proline' 0 C--N 1.348 0.517 0 C-N-CA 123.678 -1.384 . . . . 0.0 112.044 0.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.21 145.86 2.11 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.714 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -137.41 167.05 22.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.307 0.575 . . . . 0.0 111.983 -179.126 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.592 ' C ' HD23 ' A' ' 27' ' ' LEU . 5.4 tt -125.86 124.67 41.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.388 179.2 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.5 m -116.69 130.53 56.79 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.147 0.499 . . . . 0.0 112.056 -178.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.504 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 58.7 t90 -100.63 129.01 46.49 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.241 179.096 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 45.4 ttt-85 -127.75 116.99 21.07 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.504 179.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.401 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 14.5 m -44.66 155.96 0.09 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.952 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.42 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -65.4 -39.35 92.07 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.638 0.732 . . . . 0.0 109.25 179.978 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -85.03 -23.1 28.76 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 114.68 -1.146 . . . . 0.0 111.129 179.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.85 32.06 10.43 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.601 179.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -94.71 -21.86 18.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.592 0.234 . . . . 0.0 111.48 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.47 147.02 44.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.902 0.382 . . . . 0.0 111.17 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 14.7 p -139.13 138.14 41.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.126 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.487 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 32.7 t60 -136.44 145.87 45.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.984 0.421 . . . . 0.0 111.173 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 40.3 m -129.2 137.25 51.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.998 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 88.2 t -134.1 140.85 45.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 121.186 0.517 . . . . 0.0 111.754 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.598 HG22 HG23 ' A' ' 44' ' ' THR . 1.7 p -87.95 117.77 32.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 178.024 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.998 HD13 HD13 ' A' ' 107' ' ' ILE . 58.2 mt -75.21 -29.66 60.39 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -178.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.453 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 8.1 t -55.86 -22.16 23.76 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.598 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -94.8 -21.63 18.59 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.137 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.868 HD12 ' HB3' ' A' ' 62' ' ' LEU . 39.3 mm -57.95 88.26 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.983 0.421 . . . . 0.0 110.922 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -70.04 -29.06 66.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.383 -179.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.68 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 18.2 mttm -138.99 142.36 38.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.969 0.414 . . . . 0.0 111.575 -179.294 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.722 HD23 ' HG2' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -124.71 124.41 42.11 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.609 179.134 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -116.82 139.32 50.74 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.049 -179.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.509 ' HB3' ' CE ' ' A' ' 101' ' ' LYS . . . -143.39 144.22 31.96 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.969 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 32.3 p -75.65 113.44 26.67 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.548 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.46 160.57 35.02 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.545 2.164 . . . . 0.0 112.643 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.01 -42.97 77.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.243 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.5 m -58.29 -27.63 64.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.725 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 23.4 t -85.06 118.2 24.49 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.891 179.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -56.22 -18.7 11.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.583 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -65.44 159.03 25.18 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.871 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.438 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 26.8 mtp -142.92 79.92 1.67 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.819 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 29.3 mtm -154.7 169.09 24.72 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.152 0.501 . . . . 0.0 111.633 -179.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.453 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -140.79 123.88 16.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.529 -0.759 . . . . 0.0 109.955 179.502 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 47.1 ttt180 -113.43 137.11 52.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.853 0.358 . . . . 0.0 111.789 -179.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.868 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -112.61 144.08 42.71 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.624 179.749 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.68 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 2.0 mm -114.79 124.32 71.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.025 179.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -90.37 129.93 9.99 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.466 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 48.3 mttt -45.9 152.43 0.37 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.738 0.304 . . . . 0.0 111.284 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.704 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.0 OUTLIER -122.23 -162.89 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.865 -179.944 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.704 ' H ' HG22 ' A' ' 66' ' ' VAL . 9.7 t0 179.67 51.52 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.402 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.598 ' OE2' HG12 ' A' ' 81' ' ' VAL . 50.8 mt-10 -57.5 -22.3 43.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.402 -179.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.9 m -63.89 -14.26 52.01 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.135 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.2 mtmt -70.14 -45.47 66.75 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.846 0.355 . . . . 0.0 111.307 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.1 mttm 61.42 93.31 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.672 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.83 151.44 25.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.001 -179.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.6 mmtm -86.16 145.44 27.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.076 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 43.7 p30 -95.77 177.45 5.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.896 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -60.28 -19.98 57.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.337 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -88.45 9.75 22.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.513 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 70.31 17.86 74.6 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.696 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -115.52 145.87 42.23 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.862 0.363 . . . . 0.0 110.754 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 55.7 mp0 -74.56 142.5 44.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.97 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.478 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.0 m -131.36 158.88 43.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.01 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.598 HG12 ' OE2' ' A' ' 68' ' ' GLU . 15.4 t -102.29 98.52 10.67 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.712 178.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.478 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 87.2 Cg_exo -45.83 163.49 0.09 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.493 2.129 . . . . 0.0 112.578 -179.089 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.462 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 21.5 mtpp -117.99 147.74 41.96 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.97 0.414 . . . . 0.0 110.991 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 16.5 Cg_exo -72.7 136.27 25.29 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 123.363 2.708 . . . . 0.0 112.665 -179.045 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 40.0 mm-40 -67.01 149.32 50.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.72 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.2 mtp85 -151.59 120.0 6.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.747 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -104.59 144.94 31.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.769 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.4 ttt -122.94 118.34 27.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.887 0.375 . . . . 0.0 111.224 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.492 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 93.7 m-85 -124.98 141.94 51.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.521 179.713 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 1.3 p -114.0 135.67 53.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.899 0.38 . . . . 0.0 111.054 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.496 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 23.8 m-85 -122.47 156.48 34.01 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.75 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.438 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 57.6 m-20 -118.78 20.3 12.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.111 179.713 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -147.9 110.2 4.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.844 0.354 . . . . 0.0 110.669 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 15.5 mtt-85 -54.46 -29.33 49.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.066 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -75.79 -55.04 6.01 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.356 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 46.6 t -56.08 -47.41 80.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.622 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.5 ppp? -63.06 -35.55 80.62 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.84 179.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -61.12 -35.19 76.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.397 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -67.9 -35.38 78.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.197 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.44 HG22 HD12 ' A' ' 104' ' ' LEU . 18.3 mm -70.73 -52.07 31.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.719 179.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.517 ' CG ' HD11 ' A' ' 48' ' ' LEU . 0.6 OUTLIER -61.58 -28.04 69.06 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.862 179.85 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 46.3 mtm -78.46 -40.81 34.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.655 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.15 -31.84 49.96 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.624 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.702 ' HA ' HD12 ' A' ' 107' ' ' ILE . 14.0 mt -65.94 -39.89 90.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.887 0.375 . . . . 0.0 110.661 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.777 ' HA ' HD12 ' A' ' 108' ' ' ILE . 1.4 mt-30 -63.1 -28.43 70.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.037 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -70.25 -36.85 74.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.052 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.998 HD13 HD13 ' A' ' 42' ' ' LEU . 6.0 mt -69.47 -46.98 74.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.356 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.817 HG22 ' CD ' ' A' ' 112' ' ' LYS . 2.3 mt -57.22 -61.11 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.597 0 CA-C-O 121.696 0.76 . . . . 0.0 109.584 179.278 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 29.9 m -51.51 -28.68 14.21 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.458 179.049 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 4.3 mtt-85 -66.27 -35.35 80.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.787 179.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.406 ' CZ ' ' HB2' ' A' ' 43' ' ' SER . 79.8 m-85 -93.13 -34.48 13.62 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.954 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.817 ' CD ' HG22 ' A' ' 108' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 CA-C-O 120.982 0.42 . . . . 0.0 110.748 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.742 0.306 . . . . 0.0 111.024 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.458 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 52.3 m80 64.53 29.05 13.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.207 0.527 . . . . 0.0 111.367 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.502 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 0.9 OUTLIER -172.69 139.97 0.96 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.549 179.022 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.402 ' CA ' ' CG1' ' A' ' 96' ' ' VAL . . . -171.49 118.27 0.73 Allowed Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.319 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.647 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -47.84 100.2 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.18 0.514 . . . . 0.0 111.212 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.829 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -114.63 152.19 32.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.914 -178.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.555 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -100.57 123.72 53.68 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.259 0 CA-C-O 120.956 0.408 . . . . 0.0 110.414 178.998 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.502 ' HB3' ' CZ3' ' A' ' 29' ' ' TRP . 14.4 t80 -111.3 131.16 55.37 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.173 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.43 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 37.1 mt-10 54.85 34.94 23.15 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.936 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.5 mttm 75.84 1.78 3.58 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.35 -179.178 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.522 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.9 t -100.04 154.6 4.33 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.69 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 178.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.555 ' HA ' HG13 ' A' ' 8' ' ' ILE . 94.4 p -97.01 149.62 21.71 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.674 0.75 . . . . 0.0 112.776 -178.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.436 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 174.38 -179.84 45.46 Favored Glycine 0 N--CA 1.447 -0.623 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.241 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.647 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -107.15 141.93 21.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 117.801 0.801 . . . . 0.0 110.583 179.407 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.88 HG12 HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -106.73 118.43 54.44 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 CA-C-N 115.283 -0.871 . . . . 0.0 108.653 179.527 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.468 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -120.53 131.2 54.58 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.223 0.535 . . . . 0.0 111.213 -178.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.646 HG23 HD11 ' A' ' 42' ' ' LEU . 76.9 mt -103.25 140.22 22.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.207 -179.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -131.54 111.46 11.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.882 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -90.61 6.35 44.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.214 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -79.28 -17.88 53.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.9 0.381 . . . . 0.0 110.448 179.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -100.25 143.04 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.095 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.446 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.0 t -115.33 116.47 41.79 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.722 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.459 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 1.5 Cg_endo -80.8 143.24 61.68 Favored 'Cis proline' 0 C--N 1.348 0.525 0 C-N-CA 123.816 -1.327 . . . . 0.0 111.956 -0.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.26 142.42 2.91 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.053 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -135.61 167.3 21.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.191 0.519 . . . . 0.0 111.57 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.88 HD21 HG12 ' A' ' 16' ' ' ILE . 4.8 tt -121.04 130.94 53.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.806 179.595 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 48.0 m -117.74 126.01 51.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.199 0.524 . . . . 0.0 112.074 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.502 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 56.9 t90 -100.58 129.09 46.47 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.075 179.07 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 26.2 ttt85 -123.94 117.57 25.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.91 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.413 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 17.9 t -45.51 166.53 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.102 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.77 -42.64 57.81 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-O 121.452 0.644 . . . . 0.0 109.62 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -86.46 -16.62 36.54 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.079 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.8 34.24 13.82 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.238 -179.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -97.75 -21.62 16.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.573 0.225 . . . . 0.0 111.6 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.458 ' NZ ' HG21 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -138.99 146.76 41.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.027 0.442 . . . . 0.0 111.597 -179.892 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 47.5 t -139.56 140.49 36.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.769 179.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.5 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 38.1 t60 -135.55 145.58 47.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.023 0.44 . . . . 0.0 111.321 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 47.7 m -129.32 135.27 48.52 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.86 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.4 t -130.84 140.89 47.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 121.142 0.496 . . . . 0.0 111.612 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.623 HG22 HG23 ' A' ' 44' ' ' THR . 2.0 p -86.41 117.78 31.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 178.214 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 1.043 HD13 HD13 ' A' ' 107' ' ' ILE . 66.3 mt -75.39 -30.68 60.21 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.259 -0.428 . . . . 0.0 112.092 -178.618 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.459 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 11.4 t -55.64 -21.88 20.03 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 -178.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.623 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -94.41 -21.57 18.86 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.718 0.294 . . . . 0.0 111.36 -179.673 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.716 HD12 ' HB3' ' A' ' 62' ' ' LEU . 37.3 mm -51.76 92.71 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.97 0.414 . . . . 0.0 111.091 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -66.07 -29.73 70.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.109 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.634 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 18.2 mttp -153.35 158.99 42.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.977 0.418 . . . . 0.0 111.302 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.517 HD23 ' HG3' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -131.66 128.82 39.86 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.948 179.381 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -119.92 144.97 47.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.93 0.395 . . . . 0.0 111.072 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.812 ' HB2' HD12 ' A' ' 60' ' ' LEU . . . -148.06 141.63 25.47 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.033 179.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.53 HG21 ' HB3' ' A' ' 57' ' ' LYS . 73.3 p -75.69 117.17 61.6 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.587 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -62.05 160.56 29.57 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.519 2.146 . . . . 0.0 112.564 -179.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.67 -43.11 80.08 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.095 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 84.3 p -62.32 -27.48 69.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.053 0.454 . . . . 0.0 110.558 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.4 m -79.72 120.52 24.13 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.844 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.4 tp10 -55.62 -19.02 8.98 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.453 179.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.53 ' HB3' HG21 ' A' ' 51' ' ' THR . 0.0 OUTLIER -71.51 141.13 50.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.9 179.859 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 63.5 mtp -131.25 79.81 1.9 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.542 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 38.3 mtm -155.79 169.09 25.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.163 0.506 . . . . 0.0 111.527 -179.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.812 HD12 ' HB2' ' A' ' 50' ' ' ALA . 4.7 tp -134.17 124.03 25.34 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.113 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 53.2 ttt180 -112.27 126.53 55.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.938 0.399 . . . . 0.0 111.783 -179.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.716 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -105.47 143.7 33.27 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.38 179.423 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.634 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.5 mm -108.78 121.98 62.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.744 0.307 . . . . 0.0 111.174 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -90.5 128.09 9.11 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.206 179.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 23.6 mttt -50.04 146.09 5.14 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.879 0.371 . . . . 0.0 111.164 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.737 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.4 p -111.14 -162.15 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.051 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.737 ' H ' HG22 ' A' ' 66' ' ' VAL . 7.2 m-20 -173.03 71.62 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.245 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.453 ' OE2' HG21 ' A' ' 81' ' ' VAL . 49.9 mt-10 -55.73 -22.28 22.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.437 -179.497 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 26.8 t -59.35 -17.48 30.11 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.085 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 62.3 mmtt -64.8 -45.28 86.91 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.794 0.33 . . . . 0.0 111.025 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.3 mptt 61.63 94.08 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.747 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.404 ' CG ' ' HG3' ' A' ' 82' ' ' PRO . 26.2 mmt180 -90.74 165.77 13.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.888 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.8 mttp -125.54 147.4 49.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.129 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -78.35 172.43 13.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.746 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -57.67 -24.0 54.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.227 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 48.8 mp0 -95.1 19.59 10.27 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.28 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.52 9.23 84.62 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.901 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -67.3 -163.5 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.696 0.284 . . . . 0.0 110.799 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -137.95 138.19 38.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.715 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.482 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 1.8 m -140.62 156.32 23.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.221 0.534 . . . . 0.0 111.376 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.477 HG13 ' O ' ' A' ' 81' ' ' VAL . 3.0 p -99.12 98.96 7.16 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 114.993 -1.003 . . . . 0.0 109.916 179.257 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.482 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 96.8 Cg_exo -41.9 145.32 0.77 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.663 2.242 . . . . 0.0 112.853 -178.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.451 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 3.4 mmpt? -94.45 153.12 40.44 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.995 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 19.0 Cg_exo -71.55 141.65 38.67 Favored 'Trans proline' 0 N--CA 1.466 -0.133 0 C-N-CA 123.406 2.737 . . . . 0.0 112.7 -179.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -65.55 147.26 53.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.859 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.419 ' HE ' HG23 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -149.63 119.8 7.26 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.668 179.931 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -100.62 156.93 17.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.709 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.8 ttt -133.53 126.82 31.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.237 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.636 ' CE1' HD11 ' A' ' 16' ' ' ILE . 90.2 m-85 -134.22 148.19 50.82 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.518 179.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 38.7 t -128.56 133.1 48.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.952 0.406 . . . . 0.0 111.356 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.829 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 0.7 OUTLIER -123.38 160.99 25.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.286 179.679 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 36.1 m-20 -114.3 28.36 8.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.846 0.355 . . . . 0.0 110.876 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.592 ' ND2' HG23 ' A' ' 96' ' ' VAL . 44.9 t-20 -152.7 110.12 3.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.608 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.84 -31.17 37.68 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.016 0.436 . . . . 0.0 110.892 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.61 -54.87 11.91 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.944 179.808 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.592 HG23 ' ND2' ' A' ' 93' ' ' ASN . 50.8 t -58.76 -35.73 57.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.06 0.457 . . . . 0.0 110.332 179.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.484 ' HG3' ' CD1' ' A' ' 91' ' ' PHE . 1.7 ttp -66.74 -38.56 86.89 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.641 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.5 ' O ' ' HB3' ' A' ' 102' ' ' MET . 52.0 t0 -69.36 -35.32 75.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.769 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -61.57 -35.64 78.39 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.154 179.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.514 HG21 HD22 ' A' ' 60' ' ' LEU . 18.1 mm -71.69 -50.86 36.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.791 179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.485 ' O ' HD21 ' A' ' 48' ' ' LEU . 1.0 OUTLIER -63.24 -27.37 69.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.798 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.5 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.7 OUTLIER -78.51 -41.74 31.52 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.201 179.626 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.603 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -71.92 -40.08 69.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.804 -179.999 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.649 ' HA ' HD12 ' A' ' 107' ' ' ILE . 13.6 mt -61.62 -38.8 88.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.764 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.779 ' HA ' HD12 ' A' ' 108' ' ' ILE . 5.2 mt-30 -63.42 -27.07 69.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.96 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -70.08 -34.07 72.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.124 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.043 HD13 HD13 ' A' ' 42' ' ' LEU . 3.8 mt -74.22 -45.83 46.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.561 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.863 HG22 ' HD3' ' A' ' 112' ' ' LYS . 2.3 mt -56.64 -61.25 1.28 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.542 0 CA-C-O 121.734 0.778 . . . . 0.0 109.5 179.388 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.1 t -49.45 -28.87 5.74 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.783 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 7.2 mtt-85 -67.5 -35.33 78.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.625 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -93.41 -31.88 14.45 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.729 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.863 ' HD3' HG22 ' A' ' 108' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.523 179.676 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.3 m . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.824 0.345 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.418 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 25.3 m80 64.37 30.52 13.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.173 0.511 . . . . 0.0 110.999 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.559 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 88.4 p 174.91 126.69 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.634 178.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.419 ' O ' ' C ' ' A' ' 6' ' ' ALA . . . -163.6 110.37 0.42 Allowed Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.868 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.584 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -33.11 116.33 0.23 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.812 0.339 . . . . 0.0 111.261 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.691 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -133.63 151.84 51.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.081 -0.508 . . . . 0.0 112.08 -178.744 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.599 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.0 OUTLIER -97.62 125.12 50.85 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.226 0 CA-C-O 121.062 0.458 . . . . 0.0 110.56 179.203 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.508 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 25.2 t80 -116.65 128.52 55.45 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.912 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.421 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 88.7 mt-10 59.31 33.58 22.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.721 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.7 mttt 75.94 1.87 3.56 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.183 -178.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.501 HG21 ' HE2' ' A' ' 36' ' ' LYS . 35.2 t -101.13 152.07 5.22 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.755 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 178.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.599 ' HA ' HG13 ' A' ' 8' ' ' ILE . 83.4 p -90.65 146.0 24.39 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 121.377 0.608 . . . . 0.0 111.518 -179.384 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.444 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -177.07 -179.17 47.31 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.702 -179.565 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.584 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.4 mm -105.21 136.2 40.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 120.859 0.362 . . . . 0.0 110.285 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.872 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.58 117.89 53.23 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 178.934 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.473 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -124.17 133.73 53.49 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.359 -178.118 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.769 HG23 HD11 ' A' ' 42' ' ' LEU . 82.6 mt -105.8 140.0 25.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.353 -179.031 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -131.36 114.81 15.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.841 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -92.83 5.33 51.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.364 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -78.95 -17.97 54.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.035 0.445 . . . . 0.0 110.383 179.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.25 143.48 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.866 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.8 m -117.78 119.66 33.69 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.861 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.433 ' HB3' ' HB3' ' A' ' 43' ' ' SER . 3.4 Cg_exo -78.71 141.1 62.53 Favored 'Cis proline' 0 C--N 1.348 0.548 0 C-N-CA 123.621 -1.408 . . . . 0.0 111.786 -0.151 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -43.59 137.68 2.83 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.01 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.409 ' HA ' ' HG ' ' A' ' 42' ' ' LEU . 72.3 mt-10 -130.24 165.04 23.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.159 0.504 . . . . 0.0 111.835 -179.049 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.872 HD21 HG12 ' A' ' 16' ' ' ILE . 7.0 tt -121.12 125.68 47.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.472 179.099 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.6 m -113.29 128.9 56.62 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.486 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 58.9 t90 -100.56 126.63 47.03 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.931 178.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.46 117.81 25.24 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.653 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 29.7 t -44.42 157.29 0.06 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.882 -179.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.444 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.2 OUTLIER -65.18 -39.11 92.44 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.624 0.726 . . . . 0.0 109.146 179.863 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 -85.24 -23.95 28.0 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.629 -1.169 . . . . 0.0 111.017 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 91.28 31.69 9.47 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.615 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -100.0 -19.94 16.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.696 0.284 . . . . 0.0 111.437 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.501 ' HE2' HG21 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -131.62 141.49 49.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.825 0.345 . . . . 0.0 111.092 -179.926 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 13.5 p -139.13 135.02 41.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.27 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.508 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 70.8 t60 -135.07 146.32 48.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.201 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 40.0 m -126.58 140.52 52.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.077 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 93.3 t -134.68 140.93 44.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 121.118 0.485 . . . . 0.0 111.698 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.6 HG22 HG23 ' A' ' 44' ' ' THR . 1.5 p -86.02 118.09 31.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 1.152 HD13 HD13 ' A' ' 107' ' ' ILE . 46.3 mt -74.53 -30.15 61.66 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -178.313 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.433 ' HB3' ' HB3' ' A' ' 24' ' ' PRO . 60.2 p -56.14 -22.06 26.27 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -178.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.6 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -90.82 -24.29 20.34 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.883 0.373 . . . . 0.0 111.331 -179.596 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.955 HD12 ' HB3' ' A' ' 62' ' ' LEU . 42.3 mm -57.78 92.04 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.806 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -80.42 -26.11 38.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.734 -179.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.691 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 19.4 mtmt -137.61 152.83 49.79 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.201 0.524 . . . . 0.0 112.049 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.818 HD21 ' HB3' ' A' ' 104' ' ' LEU . 22.2 mt -116.28 124.41 50.11 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.032 179.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.406 ' CB ' ' HG3' ' A' ' 61' ' ' ARG . 10.4 mp0 -121.91 130.31 53.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.893 0.378 . . . . 0.0 110.823 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.918 ' HB2' HD12 ' A' ' 60' ' ' LEU . . . -144.66 143.92 30.98 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.965 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.477 HG23 ' O ' ' A' ' 59' ' ' MET . 72.7 p -75.67 123.74 88.52 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.46 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -61.1 154.54 56.57 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.597 2.198 . . . . 0.0 112.537 -179.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.17 -42.49 98.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.125 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.6 t -58.07 -27.61 63.8 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.05 0.452 . . . . 0.0 110.831 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.6 t -80.21 119.16 22.6 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.808 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -55.95 -18.65 9.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.521 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.3 mttm -81.4 126.23 31.36 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.94 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.49 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 28.4 mtp -107.93 117.62 34.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.593 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.477 ' O ' HG23 ' A' ' 51' ' ' THR . 1.7 ttm -174.59 167.97 3.79 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.185 0.517 . . . . 0.0 111.791 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.918 HD12 ' HB2' ' A' ' 50' ' ' ALA . 1.6 tp -153.58 138.97 17.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.918 179.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.406 ' HG3' ' CB ' ' A' ' 49' ' ' GLN . 0.2 OUTLIER -139.98 148.09 41.39 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.005 0.431 . . . . 0.0 111.869 -179.649 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.955 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -109.47 144.34 37.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.582 179.919 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.691 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 2.5 mm -105.82 121.72 58.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.766 0.317 . . . . 0.0 111.112 179.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -86.07 131.39 10.48 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.313 179.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.4 mttt -46.34 150.63 0.61 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.702 0.287 . . . . 0.0 111.334 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.7 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.3 p -116.86 -162.09 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.973 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.7 ' H ' HG22 ' A' ' 66' ' ' VAL . 25.9 m-20 -166.29 59.8 0.1 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.324 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.616 ' HB3' HG13 ' A' ' 81' ' ' VAL . 86.7 mt-10 -57.44 -21.5 37.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.411 -179.658 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 32.7 t -58.6 -18.23 28.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.116 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -67.56 -51.43 50.77 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.887 0.375 . . . . 0.0 110.956 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.6 mttt 57.65 88.12 0.06 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.033 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.71 135.33 39.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.811 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 18.1 mmtm -75.24 144.84 42.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.313 -179.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -95.23 174.15 7.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.87 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -59.6 -19.88 51.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.324 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 49.3 mp0 -87.66 7.69 28.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.434 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.05 18.59 79.24 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.6 -0.81 . . . . 0.0 112.685 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -115.56 145.51 42.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.746 0.307 . . . . 0.0 111.024 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -76.45 146.32 38.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.897 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.441 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 1.3 m -133.7 158.72 42.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.213 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.616 HG13 ' HB3' ' A' ' 68' ' ' GLU . 16.2 t -103.55 98.68 13.21 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.724 178.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.441 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 87.4 Cg_exo -46.13 145.52 5.32 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 122.448 2.099 . . . . 0.0 112.438 -179.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.433 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 2.1 mptt -83.45 143.44 44.53 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.056 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 15.1 Cg_exo -73.55 152.56 48.72 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 123.558 2.839 . . . . 0.0 112.629 -178.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -67.2 147.76 52.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.585 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.8 mtp-105 -147.56 120.05 8.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.156 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -99.06 159.05 15.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.402 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 23.1 ttt -133.41 138.94 46.47 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.006 0.431 . . . . 0.0 111.567 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.716 ' CD1' HD11 ' A' ' 16' ' ' ILE . 95.3 m-85 -152.02 125.41 8.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.214 179.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.7 t -98.98 133.01 43.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.095 0.474 . . . . 0.0 111.314 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.691 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 80.7 m-85 -120.19 152.71 37.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.629 179.664 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.49 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 16.7 m-20 -108.4 -6.62 16.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.371 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -121.64 108.73 13.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.871 0.367 . . . . 0.0 110.749 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.86 -28.62 3.88 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.112 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -76.28 -54.93 6.06 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.205 -179.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 58.9 t -53.42 -47.88 58.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.772 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.411 ' HB3' ' CG ' ' A' ' 91' ' ' PHE . 0.0 OUTLIER -61.4 -35.68 78.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.222 179.473 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 54.5 t0 -64.63 -35.63 81.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.465 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.428 ' O ' ' HB ' ' A' ' 103' ' ' THR . 53.9 m-80 -65.45 -42.93 91.8 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.971 179.228 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.573 HD12 ' CG2' ' A' ' 16' ' ' ILE . 27.4 mm -62.38 -52.15 63.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.573 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.426 ' O ' HD13 ' A' ' 48' ' ' LEU . 6.9 pttp -64.05 -27.87 69.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.657 179.685 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 38.4 mtm -78.84 -40.41 32.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.741 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.451 HG22 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -75.56 -43.52 48.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.016 -179.825 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 1.108 HD21 HD22 ' A' ' 42' ' ' LEU . 3.5 mt -61.43 -33.97 74.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.818 0.342 . . . . 0.0 110.981 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.732 ' HA ' HD12 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -67.85 -26.51 66.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.696 -179.988 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -69.49 -30.1 67.89 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.559 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.152 HD13 HD13 ' A' ' 42' ' ' LEU . 3.9 mt -76.38 -45.37 34.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.244 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.732 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.1 mt -57.87 -61.44 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.63 0 CA-C-O 121.669 0.747 . . . . 0.0 109.516 179.367 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.8 m -51.76 -28.81 16.49 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.284 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 3.9 mtt180 -64.41 -35.35 80.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.524 179.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -92.77 -28.86 16.32 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.781 179.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.707 ' HD3' HG22 ' A' ' 108' ' ' ILE . 2.0 mptp? . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.75 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.0 m . . . . . 0 CA--C 1.524 -0.033 0 CA-C-O 120.787 0.327 . . . . 0.0 111.07 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.422 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 66.3 m80 -141.35 34.99 1.67 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.136 0.493 . . . . 0.0 110.963 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.49 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 6.2 p -173.32 116.75 0.27 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.877 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -146.57 117.67 0.97 Allowed Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.391 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.638 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -41.38 108.69 0.1 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.178 0.513 . . . . 0.0 111.673 -179.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.66 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -122.35 153.04 39.52 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.974 -178.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.546 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -100.11 125.53 53.82 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.236 0 CA-C-O 120.956 0.408 . . . . 0.0 110.35 178.881 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.508 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 5.7 t80 -113.1 130.85 56.04 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.134 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 55.4 34.29 22.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.9 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 30.9 mttm 76.28 1.21 3.37 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.322 -179.046 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.518 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.6 t -99.69 154.29 4.27 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.641 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 178.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.546 ' HA ' HG13 ' A' ' 8' ' ' ILE . 90.6 p -95.65 149.2 21.72 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.579 0.704 . . . . 0.0 112.613 -178.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.476 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.42 -179.62 46.53 Favored Glycine 0 N--CA 1.446 -0.648 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.347 -179.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.638 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.71 142.65 19.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 117.608 0.704 . . . . 0.0 110.68 179.367 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.836 HG12 HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -106.77 118.49 54.62 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.764 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 179.48 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -118.28 123.91 46.55 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.334 -178.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.422 ' O ' ' HB3' ' A' ' 3' ' ' HIS . 42.2 mt -96.74 138.46 21.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.995 -179.403 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 65.9 m-20 -131.03 114.2 14.89 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.988 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -91.92 5.93 48.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.169 179.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -78.95 -18.13 54.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.957 0.408 . . . . 0.0 110.313 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.78 145.24 10.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.886 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.424 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.0 t -119.44 115.65 33.96 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.967 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.454 ' HG2' HG23 ' A' ' 41' ' ' VAL . 79.7 Cg_endo -78.06 146.3 80.54 Favored 'Cis proline' 0 C--N 1.348 0.53 0 C-N-CA 123.42 -1.492 . . . . 0.0 112.193 0.132 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.63 137.69 8.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.629 179.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -127.3 167.05 16.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.153 0.501 . . . . 0.0 111.701 -179.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.836 HD21 HG12 ' A' ' 16' ' ' ILE . 5.0 tt -121.16 130.58 53.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.8 179.417 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.3 m -116.6 123.93 48.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.117 0.484 . . . . 0.0 111.907 -179.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.49 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 58.5 t90 -100.63 128.93 46.51 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.073 179.311 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 8.5 ttm180 -124.68 116.32 22.18 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.824 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.476 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 28.8 t -45.24 164.13 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.091 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.51 -41.42 65.94 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.498 0.666 . . . . 0.0 109.611 179.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -81.13 -22.08 39.32 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.075 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.29 33.25 10.75 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.447 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -107.33 -21.12 13.05 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.658 0.266 . . . . 0.0 111.489 -179.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.496 ' NZ ' HG21 ' A' ' 12' ' ' VAL . 7.3 mtmt -127.2 134.41 50.13 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.862 0.363 . . . . 0.0 111.176 -179.852 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.4 t -139.13 136.19 42.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.939 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.508 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 85.7 t60 -138.81 146.21 41.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.217 0.532 . . . . 0.0 111.387 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 49.6 m -126.09 139.41 53.41 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.893 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 95.8 t -131.77 140.87 47.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.094 0.474 . . . . 0.0 111.637 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.768 HG13 ' CG2' ' A' ' 44' ' ' THR . 1.4 p -85.35 118.06 31.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 178.022 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 1.029 HD13 HD13 ' A' ' 107' ' ' ILE . 61.2 mt -72.38 -30.23 64.49 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.212 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.448 ' CB ' ' HB2' ' A' ' 24' ' ' PRO . 2.3 t -53.91 -23.66 13.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.682 0.277 . . . . 0.0 111.641 -179.516 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.768 ' CG2' HG13 ' A' ' 41' ' ' VAL . 0.2 OUTLIER -84.56 -25.49 28.66 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.137 -179.855 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.622 HD12 ' HB3' ' A' ' 62' ' ' LEU . 45.6 mm -54.33 101.39 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.129 -179.505 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -95.78 -20.66 18.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.54 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.465 ' HB2' HG13 ' A' ' 63' ' ' ILE . 35.8 mttt -153.39 133.43 13.3 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.009 0.433 . . . . 0.0 111.302 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.725 HD11 ' HB3' ' A' ' 104' ' ' LEU . 54.0 mt -105.81 124.28 49.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.632 179.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -109.66 130.39 55.52 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.467 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.617 ' HB3' ' HE2' ' A' ' 101' ' ' LYS . . . -142.05 142.07 32.83 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.98 -179.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 81.3 p -75.75 137.71 70.09 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.57 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.16 152.95 55.89 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.583 2.189 . . . . 0.0 112.503 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.01 -43.0 99.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.181 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.1 m -58.01 -27.63 63.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.697 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.4 m -82.35 119.99 24.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.795 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -57.2 -18.27 14.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.456 179.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 32.0 mmtt -58.46 134.49 56.71 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.045 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.467 ' HE3' ' HB3' ' A' ' 58' ' ' MET . 30.5 mmm -122.15 100.56 7.03 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.48 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -174.81 145.15 0.85 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.008 0.432 . . . . 0.0 111.784 -179.659 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.619 HD11 ' HB2' ' A' ' 101' ' ' LYS . 2.5 tt -126.22 131.46 51.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.107 179.388 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.79 124.05 51.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.96 0.41 . . . . 0.0 111.959 -179.071 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.622 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.4 OUTLIER -92.91 143.53 26.16 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.973 178.753 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.465 HG13 ' HB2' ' A' ' 47' ' ' LYS . 1.1 mm -118.55 120.47 64.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.263 -179.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -88.79 147.01 19.57 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.068 179.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -59.38 135.35 57.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.9 0.381 . . . . 0.0 111.077 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.487 ' CG2' ' N ' ' A' ' 67' ' ' ASP . 1.8 p -77.88 161.13 4.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.415 0.626 . . . . 0.0 111.563 -179.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.487 ' N ' ' CG2' ' A' ' 66' ' ' VAL . 91.2 m-20 -90.77 77.51 6.26 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.627 179.628 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -63.56 -15.98 59.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.377 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 34.0 m -55.26 -21.98 16.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.808 0.337 . . . . 0.0 111.072 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.6 mmtp -78.81 -68.23 0.67 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.864 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.1 mttp 59.86 92.98 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.988 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.422 ' O ' ' N ' ' A' ' 80' ' ' VAL . 20.0 mtm-85 -93.49 -176.95 4.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.414 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -125.82 153.78 43.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.982 0.42 . . . . 0.0 111.165 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -87.03 168.39 13.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.816 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -58.47 -21.05 50.16 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.4 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -90.99 7.53 39.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.614 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.82 -11.91 68.97 Favored Glycine 0 C--N 1.332 0.339 0 C-N-CA 120.511 -0.852 . . . . 0.0 112.755 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -66.72 175.48 2.37 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.74 0.305 . . . . 0.0 110.829 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -96.66 163.76 12.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.924 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.525 HG12 ' N ' ' A' ' 81' ' ' VAL . 22.1 t -135.72 157.78 39.16 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 CA-C-O 121.519 0.676 . . . . 0.0 111.869 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.525 ' N ' HG12 ' A' ' 80' ' ' VAL . 15.6 t -124.73 97.89 38.06 Favored Pre-proline 0 C--N 1.32 -0.715 0 CA-C-N 114.819 -1.082 . . . . 0.0 108.354 177.596 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -45.05 166.24 0.05 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.253 1.969 . . . . 0.0 112.61 -178.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.52 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 1.1 mtmm -84.53 137.16 39.08 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 120.934 0.397 . . . . 0.0 110.958 -179.752 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.52 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 10.1 Cg_exo -76.23 165.78 28.87 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 123.367 2.711 . . . . 0.0 112.613 -179.119 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -65.5 156.1 33.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.534 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 66.7 mtm180 -148.68 133.25 17.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.82 0.343 . . . . 0.0 111.154 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.413 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 46.6 m-70 -116.31 159.03 22.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.503 179.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.3 ttt -125.69 142.1 51.68 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.996 0.427 . . . . 0.0 111.37 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.558 ' CE2' HD11 ' A' ' 16' ' ' ILE . 95.9 m-85 -152.02 125.81 9.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.514 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.3 t -101.61 143.02 32.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.989 0.423 . . . . 0.0 111.18 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.66 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 54.2 m-85 -130.09 172.48 11.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.671 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 74.8 m-20 -132.36 23.38 4.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.184 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -154.08 116.43 4.34 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.832 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 9.0 mtt85 -57.73 -31.46 66.47 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.001 0.429 . . . . 0.0 110.751 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.03 -54.99 18.99 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.724 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 61.8 t -61.56 -37.55 78.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.186 179.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.507 ' HG3' ' CG ' ' A' ' 91' ' ' PHE . 1.4 ttp -69.3 -33.19 72.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.392 179.352 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.467 ' O ' ' HB3' ' A' ' 102' ' ' MET . 22.0 t70 -72.41 -25.13 61.37 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.146 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -80.98 -51.59 8.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.977 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 16.8 mm -53.83 -52.07 38.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.027 0.442 . . . . 0.0 110.782 179.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.619 ' HB2' HD11 ' A' ' 60' ' ' LEU . 0.6 OUTLIER -60.59 -27.86 68.04 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.93 179.726 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.467 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.8 OUTLIER -78.78 -43.96 24.3 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.902 -179.972 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.84 -44.31 70.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.087 -179.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.78 ' CD2' HD22 ' A' ' 42' ' ' LEU . 16.2 mt -58.33 -38.96 78.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.832 0.349 . . . . 0.0 110.971 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.77 ' HA ' HD12 ' A' ' 108' ' ' ILE . 2.0 mt-30 -63.09 -28.72 70.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.961 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -68.49 -37.21 79.9 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.819 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.029 HD13 HD13 ' A' ' 42' ' ' LEU . 3.4 mt -68.68 -44.55 82.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.335 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.77 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.1 mt -59.96 -61.02 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.618 0 CA-C-O 121.7 0.762 . . . . 0.0 109.319 179.024 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.5 t -50.6 -29.27 10.46 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.392 -1.276 . . . . 0.0 110.903 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 51.1 mtt180 -67.88 -33.81 75.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.079 0.466 . . . . 0.0 110.52 179.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -105.47 -0.97 25.45 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.911 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.839 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.5 t . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.814 0.34 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 76.2 m80 63.59 33.33 13.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.111 0.482 . . . . 0.0 111.14 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.584 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 64.2 p 178.25 171.83 0.71 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.841 179.139 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 155.78 119.15 0.63 Allowed Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.21 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.628 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -47.07 108.73 0.16 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.101 0.476 . . . . 0.0 111.404 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.814 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -123.7 153.18 41.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.81 -178.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.562 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.9 OUTLIER -99.72 124.36 53.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.976 0.417 . . . . 0.0 110.419 179.021 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.505 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 19.7 t80 -113.19 129.83 56.4 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.085 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.421 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 83.8 mt-10 57.08 34.46 24.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.894 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 29.2 mmtt 75.77 1.93 3.63 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.24 -179.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.522 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.9 t -100.78 154.39 4.58 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.634 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.562 ' HA ' HG13 ' A' ' 8' ' ' ILE . 79.9 p -96.67 148.7 22.6 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-O 121.557 0.694 . . . . 0.0 112.517 -178.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.484 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.15 -179.74 46.22 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-N 114.649 -1.16 . . . . 0.0 110.404 -179.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.628 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.41 141.55 21.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 117.611 0.706 . . . . 0.0 110.602 179.378 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.683 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.75 118.57 54.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 179.53 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.485 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -119.8 139.83 51.72 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.19 -178.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.513 ' CG1' HD12 ' A' ' 27' ' ' LEU . 94.1 mt -116.51 140.04 40.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.501 -178.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -125.56 111.37 14.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.7 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -94.21 7.88 43.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.244 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -80.43 -17.91 50.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.814 0.34 . . . . 0.0 110.346 179.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.49 ' CG2' ' N ' ' A' ' 23' ' ' SER . 0.6 OUTLIER -106.93 159.27 6.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.201 0.524 . . . . 0.0 111.227 -179.995 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.49 ' N ' ' CG2' ' A' ' 22' ' ' VAL . 7.1 m -131.27 121.54 18.61 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.811 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.431 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 5.7 Cg_exo -76.51 137.58 49.85 Favored 'Cis proline' 0 C--N 1.348 0.504 0 C-N-CA 123.529 -1.446 . . . . 0.0 111.873 -0.063 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.584 ' O ' HD22 ' A' ' 42' ' ' LEU . . . -44.74 140.8 2.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.679 179.614 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -127.36 158.48 37.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.324 0.583 . . . . 0.0 112.046 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.717 ' HB2' HD11 ' A' ' 42' ' ' LEU . 4.2 tt -121.39 129.9 53.3 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.127 179.064 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.0 m -121.05 125.95 48.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.255 0.55 . . . . 0.0 112.334 -178.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.485 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 63.6 t90 -100.6 128.39 46.67 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.647 178.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 55.2 ttt-85 -125.59 118.16 25.12 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.863 0.363 . . . . 0.0 111.02 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.484 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 33.3 m -45.63 166.58 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.92 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.02 -41.68 67.26 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.47 0.652 . . . . 0.0 109.754 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -100.37 -9.84 21.83 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.852 -1.067 . . . . 0.0 111.209 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 91.73 26.86 18.68 Favored Glycine 0 C--N 1.331 0.299 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.391 -179.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -71.61 -24.02 61.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.742 0.306 . . . . 0.0 111.673 -179.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.51 153.87 19.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.08 0.467 . . . . 0.0 111.489 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.8 t -139.04 132.81 39.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.699 179.593 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.505 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 43.3 t60 -133.76 145.9 50.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.195 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.46 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 52.2 m -129.04 140.18 51.72 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.303 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 90.9 t -134.56 141.62 42.87 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.197 0 CA-C-O 121.152 0.501 . . . . 0.0 111.982 179.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.73 ' HB ' HG23 ' A' ' 44' ' ' THR . 0.0 OUTLIER -88.36 117.43 31.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.719 177.995 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.767 ' H ' HD22 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -68.3 -19.87 64.72 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 120.784 0.326 . . . . 0.0 110.502 179.464 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 86.0 p -65.03 -28.28 69.38 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.07 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.73 HG23 ' HB ' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -86.71 -26.5 24.21 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.715 179.725 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.884 HD12 ' HB3' ' A' ' 62' ' ' LEU . 45.9 mm -57.24 91.31 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.036 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -60.83 -30.58 70.19 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.035 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.622 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 35.4 mttt -152.36 157.44 41.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.927 0.394 . . . . 0.0 111.21 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.61 HD23 ' HG3' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -131.34 126.03 34.23 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.934 179.456 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -122.24 141.19 51.75 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.01 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.418 ' HB2' HD11 ' A' ' 60' ' ' LEU . . . -136.99 147.86 46.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.046 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.637 HG23 ' O ' ' A' ' 59' ' ' MET . 20.1 p -75.82 124.02 88.48 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.743 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.53 160.62 49.08 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.378 2.052 . . . . 0.0 112.408 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.675 ' HB2' ' HE ' ' A' ' 94' ' ' ARG . . . -58.68 -35.22 72.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.081 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.6 t -58.49 -25.84 62.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.005 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 32.7 t -98.57 115.01 27.68 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.822 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -58.26 -18.41 26.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.693 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.432 ' O ' HG21 ' A' ' 51' ' ' THR . 4.8 mtmm -71.45 97.37 1.63 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.985 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.501 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 12.0 mmm -82.1 108.27 15.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.765 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.637 ' O ' HG23 ' A' ' 51' ' ' THR . 1.3 tmm? -176.52 145.6 0.57 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.108 0.48 . . . . 0.0 111.742 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.493 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -115.69 159.99 20.65 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.938 179.354 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 7.3 tpt180 -145.86 127.72 15.4 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.884 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -105.56 144.17 32.69 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.316 179.126 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.622 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 2.4 mm -103.65 114.32 42.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.744 0.306 . . . . 0.0 111.416 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -79.32 129.19 8.99 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.106 179.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 20.6 mttt -52.03 148.14 6.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.939 0.4 . . . . 0.0 111.197 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.794 HG22 ' H ' ' A' ' 67' ' ' ASP . 2.1 p -108.76 -162.34 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.876 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.794 ' H ' HG22 ' A' ' 66' ' ' VAL . 5.7 t70 -156.7 71.49 0.69 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.97 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.525 ' CG ' HG13 ' A' ' 81' ' ' VAL . 42.0 mp0 -55.67 -21.56 18.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.466 -179.263 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.1 t -56.83 -19.68 18.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.084 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 32.3 mmtt -72.45 -47.67 47.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.978 0.418 . . . . 0.0 110.89 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.2 mmtt 62.85 94.7 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.923 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 15.0 mtt-85 -99.51 143.86 29.27 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.944 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.8 mmtp -87.48 145.66 26.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.005 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.495 ' HB3' HG11 ' A' ' 80' ' ' VAL . 43.6 p30 -97.44 177.6 5.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.107 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -60.99 -19.36 61.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.302 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -88.38 11.41 16.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.516 -179.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 68.67 17.62 71.24 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.708 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -117.09 146.24 43.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.94 0.4 . . . . 0.0 110.876 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -70.71 144.28 51.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.97 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.495 HG11 ' HB3' ' A' ' 74' ' ' ASP . 2.8 m -140.51 158.76 24.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.195 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.525 HG13 ' CG ' ' A' ' 68' ' ' GLU . 18.6 t -83.31 110.37 23.62 Favored Pre-proline 0 C--N 1.327 -0.378 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.429 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.44 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 71.7 Cg_exo -48.58 145.9 11.66 Favored 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 122.094 1.862 . . . . 0.0 112.668 -178.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.486 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 29.0 mttm -74.66 102.93 0.74 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.135 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.486 ' HD2' ' HA ' ' A' ' 83' ' ' LYS . 1.0 OUTLIER -40.17 149.38 0.14 Allowed 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 123.534 2.823 . . . . 0.0 112.642 179.275 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.36 155.15 36.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.771 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 55.6 mtt85 -153.49 119.83 5.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.68 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 84.4 m-70 -93.5 154.49 17.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.643 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.4 ttt -130.88 118.97 21.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.905 0.383 . . . . 0.0 111.484 -179.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.599 ' CE2' HD11 ' A' ' 16' ' ' ILE . 94.4 m-85 -127.73 125.47 40.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.215 179.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.98 131.44 44.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.995 0.426 . . . . 0.0 111.211 -179.538 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.814 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 12.1 m-85 -121.08 161.44 21.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.611 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.501 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 75.1 m-20 -124.63 29.34 6.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.009 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 74.8 m-80 -156.6 112.32 2.94 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.795 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.675 ' HE ' ' HB2' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -52.71 -28.17 20.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.05 0.453 . . . . 0.0 111.044 -179.971 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.435 HG22 ' N ' ' A' ' 96' ' ' VAL . 0.9 OUTLIER -77.43 -54.91 5.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.853 179.877 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.435 ' N ' HG22 ' A' ' 95' ' ' THR . 40.3 t -56.31 -44.76 80.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.87 -179.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.404 ' CG ' ' HA ' ' A' ' 94' ' ' ARG . 0.2 OUTLIER -65.84 -35.97 82.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.115 179.261 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -66.64 -33.01 74.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.562 179.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.437 ' O ' ' HB ' ' A' ' 103' ' ' THR . 76.6 m-20 -63.49 -35.43 80.41 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.874 179.309 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.54 HD12 ' CG2' ' A' ' 16' ' ' ILE . 21.5 mm -71.07 -51.99 30.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.577 179.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.593 ' HB2' HD11 ' A' ' 48' ' ' LEU . 11.3 pttp -64.53 -27.23 68.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.614 179.663 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 44.1 mtm -78.21 -38.36 43.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.521 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.458 HG21 HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -78.61 -38.11 40.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.611 179.728 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.643 HD21 HD12 ' A' ' 42' ' ' LEU . 12.0 mt -63.54 -40.36 96.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.592 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.827 ' HA ' HD12 ' A' ' 108' ' ' ILE . 12.1 mt-30 -62.99 -27.4 69.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.979 0.419 . . . . 0.0 111.04 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -70.41 -38.65 74.66 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.151 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.678 HD13 HD23 ' A' ' 42' ' ' LEU . 60.8 mt -68.81 -46.68 79.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.543 -179.654 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.827 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.6 mt -56.61 -60.17 2.22 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.621 0 CA-C-O 121.84 0.828 . . . . 0.0 109.507 179.187 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.7 m -48.78 -29.0 4.05 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.107 -1.406 . . . . 0.0 111.389 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 50.7 mtt-85 -70.82 -32.31 69.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.046 0.45 . . . . 0.0 110.809 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -95.6 -30.85 13.57 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.018 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.802 ' HD3' HG22 ' A' ' 108' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.577 179.709 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.3 t . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.778 0.323 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.408 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 59.3 m80 65.08 32.94 9.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.077 179.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.521 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 60.4 p -175.01 164.58 3.39 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.767 179.239 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.414 ' CA ' HG13 ' A' ' 96' ' ' VAL . . . 160.87 117.93 0.46 Allowed Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.383 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.631 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -47.06 110.46 0.3 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.085 0.469 . . . . 0.0 111.459 -179.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.761 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -125.61 150.78 47.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.632 -179.064 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.568 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -99.51 124.99 53.19 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-O 121.014 0.435 . . . . 0.0 110.443 179.332 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.515 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 7.1 t80 -112.93 130.73 56.01 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.163 179.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 55.88 34.28 23.25 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.944 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 78.7 mttt 76.11 1.5 3.45 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.274 -179.09 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.53 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.6 t -100.16 154.62 4.36 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.586 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.013 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.568 ' HA ' HG13 ' A' ' 8' ' ' ILE . 89.2 p -96.47 149.15 22.05 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.638 0.733 . . . . 0.0 112.785 -178.487 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.46 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.23 -179.77 46.27 Favored Glycine 0 N--CA 1.445 -0.705 0 CA-C-N 114.436 -1.256 . . . . 0.0 110.298 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.631 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.57 143.39 17.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 117.73 0.765 . . . . 0.0 110.438 179.352 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.887 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.75 118.3 54.22 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.682 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.625 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.486 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -121.64 133.82 54.98 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.345 -178.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.622 HG23 HD11 ' A' ' 42' ' ' LEU . 90.6 mt -106.33 140.1 25.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.184 -179.028 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -131.99 111.4 11.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.904 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -89.77 6.26 42.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.312 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -79.02 -18.05 54.25 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.906 0.384 . . . . 0.0 110.398 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -98.98 144.25 12.11 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.09 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.433 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.9 t -116.47 116.32 39.2 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.755 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.447 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 1.8 Cg_endo -80.01 143.8 67.41 Favored 'Cis proline' 0 C--N 1.349 0.562 0 C-N-CA 123.819 -1.326 . . . . 0.0 111.883 -0.05 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.56 140.68 4.19 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.884 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -134.25 167.21 21.12 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.251 0.548 . . . . 0.0 111.746 -179.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.887 HD21 HG12 ' A' ' 16' ' ' ILE . 6.0 tt -121.18 128.17 52.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.674 179.572 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.3 m -115.72 128.55 55.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.174 0.511 . . . . 0.0 112.339 -178.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.48 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 57.2 t90 -100.53 130.1 46.56 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.461 -0.791 . . . . 0.0 109.714 178.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 17.0 ttt180 -124.45 115.72 21.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.831 0.348 . . . . 0.0 110.947 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.46 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 3.8 p -45.45 166.38 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.109 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.65 -42.0 59.32 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 121.416 0.627 . . . . 0.0 109.792 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 48.7 p30 -81.94 -19.44 40.7 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.313 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.89 33.88 11.89 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.271 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -108.54 -21.37 12.75 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.731 0.271 . . . . 0.0 111.731 -179.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.486 ' HE2' HG21 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -128.27 134.52 48.96 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.885 0.374 . . . . 0.0 111.103 -179.793 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 12.2 p -139.3 137.79 40.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.063 179.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.515 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 56.5 t60 -136.97 146.05 44.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.144 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 46.9 m -127.82 134.03 49.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.172 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.7 t -124.33 140.8 46.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.367 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.597 HG22 HG23 ' A' ' 44' ' ' THR . 2.0 p -85.3 117.61 30.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.12 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 1.021 HD13 HD13 ' A' ' 107' ' ' ILE . 83.5 mt -75.38 -29.67 59.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.982 -178.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.447 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 10.9 t -55.49 -22.16 19.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.867 -179.2 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.597 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -95.49 -22.14 17.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.719 0.295 . . . . 0.0 111.195 -179.896 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.796 HD12 ' HB3' ' A' ' 62' ' ' LEU . 36.7 mm -57.11 89.3 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.886 -179.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -74.32 -27.88 60.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.506 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.724 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 28.6 mtpt -141.13 146.04 36.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.132 0.492 . . . . 0.0 111.769 -179.289 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.694 HD23 ' HG2' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -132.33 124.95 29.8 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.607 179.301 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.664 ' O ' HD23 ' A' ' 60' ' ' LEU . 94.4 mt-30 -127.28 145.05 50.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.943 0.401 . . . . 0.0 111.552 -178.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -133.2 156.98 46.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.836 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 46.5 p -75.74 133.52 73.26 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.528 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.7 154.98 51.24 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.631 2.221 . . . . 0.0 112.557 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.33 -42.98 99.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.155 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.4 m -58.34 -27.53 64.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.09 0.472 . . . . 0.0 110.737 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 29.4 t -81.99 119.85 24.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.811 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -56.84 -18.44 13.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.438 179.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.6 mmtm -61.01 149.38 36.99 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.944 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.404 ' CE ' ' N ' ' A' ' 93' ' ' ASN . 15.6 mmm -133.78 79.98 1.85 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.672 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.423 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.6 OUTLIER -147.62 169.11 20.34 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.06 0.457 . . . . 0.0 112.037 -179.541 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.675 HD21 ' CD1' ' A' ' 48' ' ' LEU . 0.3 OUTLIER -144.69 131.13 19.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.872 179.47 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.469 ' HD2' HD13 ' A' ' 63' ' ' ILE . 4.0 tmm_? -113.48 132.34 55.7 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.043 0.449 . . . . 0.0 112.211 -178.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.796 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -110.48 140.64 44.55 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.229 179.246 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.724 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.2 mm -111.82 127.33 69.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.772 0.32 . . . . 0.0 111.328 179.72 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.56 129.66 9.98 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.217 179.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.6 mttt -44.35 145.63 0.79 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.833 0.349 . . . . 0.0 111.413 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.715 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.2 p -117.73 -162.05 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.815 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.715 ' H ' HG22 ' A' ' 66' ' ' VAL . 7.3 t0 -178.81 50.44 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.503 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -57.59 -22.5 45.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.334 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 23.7 t -62.1 -16.11 50.04 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.944 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.1 mttt -69.7 -39.95 76.6 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.094 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.8 mtmt 60.43 90.96 0.06 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.813 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 74.3 mmt-85 -94.4 143.88 26.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.022 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 45.4 mmtt -88.14 145.86 25.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.905 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -94.49 173.21 7.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.894 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -60.33 -20.03 57.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.23 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -86.64 4.79 38.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.426 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.3 15.22 81.73 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.606 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -111.72 144.69 40.6 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.812 0.339 . . . . 0.0 110.99 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -71.76 148.01 46.75 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.044 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.449 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 1.5 m -131.01 158.82 43.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.95 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 38.9 t -103.64 98.58 13.18 Favored Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.749 178.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.449 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 86.8 Cg_exo -46.2 162.61 0.12 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.411 2.074 . . . . 0.0 112.419 -179.106 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.507 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -117.8 143.79 33.19 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.745 179.928 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.507 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 15.2 Cg_exo -73.47 148.29 42.55 Favored 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 123.453 2.768 . . . . 0.0 112.695 -179.087 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -76.61 147.88 37.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.759 179.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.8 mtp180 -150.93 121.84 7.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.959 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -110.17 146.99 34.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.627 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -129.61 135.73 48.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.31 -179.723 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.683 ' CE1' HD11 ' A' ' 16' ' ' ILE . 97.7 m-85 -135.6 153.98 51.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.811 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.423 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.4 OUTLIER -126.55 123.89 38.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.912 0.387 . . . . 0.0 110.871 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.761 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 2.2 m-85 -112.87 172.74 6.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.808 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.4 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 23.6 p30 -124.69 26.35 7.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.218 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.404 ' N ' ' CE ' ' A' ' 58' ' ' MET . 80.4 m-20 -158.07 122.02 4.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.97 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -56.91 -35.18 68.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.191 0.519 . . . . 0.0 110.693 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.34 -50.26 60.71 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.014 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.414 HG13 ' CA ' ' A' ' 5' ' ' GLY . 52.4 t -59.48 -39.5 79.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.535 179.567 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.559 ' HG2' HD12 ' A' ' 60' ' ' LEU . 2.0 mtp -65.84 -36.58 83.86 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.525 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -68.96 -34.52 75.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.837 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.43 ' O ' ' HB ' ' A' ' 103' ' ' THR . 62.9 m-20 -61.5 -42.65 99.12 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.255 179.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.504 HD12 ' CG2' ' A' ' 16' ' ' ILE . 23.9 mm -66.49 -51.44 57.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.543 179.422 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.552 ' HB2' HD11 ' A' ' 48' ' ' LEU . 0.3 OUTLIER -65.52 -27.2 68.29 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.646 179.626 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.1 mmm -78.19 -37.5 45.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.445 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.43 ' HB ' ' O ' ' A' ' 99' ' ' ASN . 0.6 OUTLIER -80.69 -36.8 31.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.666 179.761 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.683 ' HA ' HD12 ' A' ' 107' ' ' ILE . 13.0 mt -63.64 -41.48 98.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.758 179.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.76 ' HA ' HD12 ' A' ' 108' ' ' ILE . 1.4 mt-30 -62.42 -28.46 69.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.022 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -69.53 -32.76 71.78 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.035 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.021 HD13 HD13 ' A' ' 42' ' ' LEU . 5.6 mt -75.11 -45.2 42.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.38 -179.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.76 HD12 ' HA ' ' A' ' 105' ' ' GLN . 1.9 mt -58.32 -61.13 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.556 0 CA-C-O 121.769 0.795 . . . . 0.0 109.428 179.282 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.4 m -50.72 -28.72 9.69 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.376 -1.284 . . . . 0.0 110.637 179.24 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.3 ttm180 -70.11 -48.31 58.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.263 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.417 ' CE2' ' HA ' ' A' ' 43' ' ' SER . 26.6 m-85 -74.44 -29.09 61.34 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.415 179.66 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 2.2 mttt . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.587 179.879 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.574 ' HG ' ' CE1' ' A' ' 3' ' ' HIS . 39.9 t . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.899 0.381 . . . . 0.0 110.912 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.574 ' CE1' ' HG ' ' A' ' 2' ' ' SER . 48.3 m80 -115.05 34.52 4.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.196 0.522 . . . . 0.0 110.93 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.496 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 19.2 p -171.29 141.91 1.65 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.59 179.154 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -172.54 118.19 0.7 Allowed Glycine 0 N--CA 1.446 -0.683 0 C-N-CA 120.531 -0.842 . . . . 0.0 112.429 179.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.642 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -45.68 103.25 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.122 0.487 . . . . 0.0 111.375 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.807 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -119.4 153.78 34.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.813 -178.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.649 HG23 ' O ' ' A' ' 12' ' ' VAL . 1.0 OUTLIER -99.98 126.59 53.43 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.255 0 CA-C-O 121.076 0.465 . . . . 0.0 110.372 178.968 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.505 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 22.2 t80 -114.68 128.12 56.14 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.03 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 82.8 mt-10 58.02 37.87 26.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.684 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 10' ' ' GLU . 2.3 mmtt 72.01 2.94 4.5 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.567 -179.153 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.649 ' O ' HG23 ' A' ' 8' ' ' ILE . 39.6 t -101.83 155.19 4.84 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.582 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 178.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.554 ' HA ' HG13 ' A' ' 8' ' ' ILE . 96.4 p -96.57 149.07 22.18 Favored 'General case' 0 C--N 1.313 -1.022 0 CA-C-O 121.594 0.712 . . . . 0.0 112.617 -178.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.464 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 175.64 -179.59 46.73 Favored Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 114.603 -1.18 . . . . 0.0 110.347 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.642 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.62 141.97 20.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 117.732 0.766 . . . . 0.0 110.53 179.413 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.851 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.68 118.38 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 179.551 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.411 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -119.64 135.0 54.99 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.353 -178.639 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.476 ' CG1' HD12 ' A' ' 27' ' ' LEU . 69.6 mt -107.16 140.12 26.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.597 -0.728 . . . . 0.0 111.171 -179.01 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 70.0 m-20 -132.08 113.25 13.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.925 -179.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -90.83 6.11 45.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.169 179.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 86.3 m-20 -79.48 -17.68 53.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.004 0.431 . . . . 0.0 110.478 179.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.68 143.77 13.15 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.985 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.436 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.8 t -116.94 116.16 38.21 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.867 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.442 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 2.0 Cg_endo -79.82 144.0 68.92 Favored 'Cis proline' 0 C--N 1.348 0.529 0 C-N-CA 123.782 -1.341 . . . . 0.0 111.954 0.049 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -45.68 140.68 3.27 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.014 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 68.5 mt-10 -133.62 167.11 21.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.247 0.546 . . . . 0.0 111.654 -179.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.851 HD21 HG12 ' A' ' 16' ' ' ILE . 4.3 tt -121.18 131.81 54.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.713 179.385 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.4 m -118.32 126.98 53.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.072 0.463 . . . . 0.0 112.093 -178.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.495 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 60.0 t90 -100.52 130.2 46.56 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.974 179.13 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 8.3 ttt85 -125.28 115.8 20.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.799 0.333 . . . . 0.0 110.912 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.464 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 29.5 t -45.49 166.54 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.142 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.07 -42.08 60.74 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.38 0.61 . . . . 0.0 109.663 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 89.7 m-20 -80.07 -22.72 41.94 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.126 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.57 32.96 10.67 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.469 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -108.31 -19.26 13.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.612 0.244 . . . . 0.0 111.471 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.468 ' HE2' HG21 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -127.96 134.95 49.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.791 0.329 . . . . 0.0 111.085 -179.867 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 11.8 p -138.98 139.09 41.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.11 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.505 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 65.9 t60 -135.82 146.14 47.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.124 0.488 . . . . 0.0 111.253 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 42.0 m -127.52 135.13 49.93 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.846 179.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 99.4 t -130.77 140.82 47.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.012 0.434 . . . . 0.0 111.601 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.654 HG22 HG23 ' A' ' 44' ' ' THR . 1.4 p -84.98 117.8 30.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 178.121 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 1.064 HD22 HD21 ' A' ' 104' ' ' LEU . 45.3 mt -75.44 -30.14 59.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.969 -178.622 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.442 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 11.7 t -55.27 -21.7 15.47 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.654 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -89.37 -22.97 22.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.795 0.331 . . . . 0.0 111.213 -179.7 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.51 HG12 ' HA ' ' A' ' 42' ' ' LEU . 48.3 mm -48.41 106.49 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.953 0.406 . . . . 0.0 111.206 -179.618 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -99.46 -20.09 16.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.404 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.442 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 51.2 mttp -154.53 133.01 11.99 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.961 0.41 . . . . 0.0 111.419 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.723 HD11 ' HB3' ' A' ' 104' ' ' LEU . 87.4 mt -107.7 124.36 49.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.664 179.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.492 ' O ' HD23 ' A' ' 60' ' ' LEU . 1.7 tt0 -113.78 134.95 54.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.633 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.608 ' HB1' ' HE1' ' A' ' 97' ' ' MET . . . -142.34 144.99 33.45 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.882 0.372 . . . . 0.0 111.19 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.471 HG22 ' HE2' ' A' ' 57' ' ' LYS . 72.9 p -75.87 129.99 79.72 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.765 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.5 154.31 74.78 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.538 2.159 . . . . 0.0 112.371 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.95 -34.53 74.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.125 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.1 m -59.08 -27.63 65.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.008 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 71.4 m -82.64 120.29 25.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.965 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -58.5 -17.74 23.56 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.525 179.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.471 ' HE2' HG22 ' A' ' 51' ' ' THR . 0.0 OUTLIER -84.61 148.2 26.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.184 -179.852 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.409 ' HE2' ' HB3' ' A' ' 58' ' ' MET . 17.5 mmm -119.45 128.35 53.92 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.683 -179.272 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.481 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.6 OUTLIER -179.88 165.25 1.24 Allowed 'General case' 0 N--CA 1.462 0.136 0 CA-C-O 121.251 0.548 . . . . 0.0 112.331 179.771 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.887 HD11 ' HB3' ' A' ' 101' ' ' LYS . 1.2 tt -148.48 137.3 21.6 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.305 -0.862 . . . . 0.0 109.776 179.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.35 126.72 47.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.985 0.421 . . . . 0.0 112.008 -179.186 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.463 HD11 HD22 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -99.74 139.65 35.08 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.015 179.038 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.463 HD13 ' HG2' ' A' ' 86' ' ' ARG . 1.0 OUTLIER -118.67 127.89 75.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.164 -179.761 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -95.78 156.79 21.55 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.237 179.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.4 mttp -58.3 157.9 7.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.81 0.338 . . . . 0.0 111.0 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.716 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.2 p -121.86 -162.1 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.966 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.716 ' H ' HG22 ' A' ' 66' ' ' VAL . 54.1 t0 -172.04 61.88 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.278 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.426 ' HB3' HG23 ' A' ' 81' ' ' VAL . 95.1 mt-10 -58.23 -20.79 44.59 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.245 -179.627 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 37.9 m -57.7 -19.08 24.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.087 179.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -61.68 -47.08 86.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.988 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp 62.64 95.31 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.819 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 42.9 mmt180 -103.18 165.44 11.02 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.816 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -125.55 145.3 50.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.979 0.419 . . . . 0.0 111.103 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -85.22 173.01 10.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.872 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.75 -17.76 61.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.291 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -87.65 6.99 31.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.45 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 81.73 -1.35 86.43 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.596 -0.812 . . . . 0.0 112.751 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -84.0 159.49 21.21 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.732 0.301 . . . . 0.0 110.765 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -95.95 147.6 23.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.864 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.427 ' CG2' ' N ' ' A' ' 81' ' ' VAL . 0.2 OUTLIER -140.56 152.66 21.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.597 0.713 . . . . 0.0 111.255 -179.997 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.547 HG13 ' O ' ' A' ' 81' ' ' VAL . 5.7 p -103.24 100.1 16.74 Favored Pre-proline 0 C--N 1.32 -0.708 0 CA-C-N 114.487 -1.233 . . . . 0.0 110.634 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -46.8 145.27 6.99 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.409 2.073 . . . . 0.0 112.509 -179.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -91.42 151.01 42.28 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.047 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.468 ' HA ' HG23 ' A' ' 66' ' ' VAL . 17.0 Cg_exo -72.49 161.09 45.14 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 123.466 2.777 . . . . 0.0 112.716 -178.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -65.36 138.1 57.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.749 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.463 ' HG2' HD13 ' A' ' 63' ' ' ILE . 6.2 mtp-105 -139.81 119.89 13.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.906 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.412 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 86.2 m-70 -110.22 157.44 19.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.725 179.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 3.1 ttt -127.34 140.55 52.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.95 0.405 . . . . 0.0 111.337 -179.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.67 ' CE1' HD11 ' A' ' 16' ' ' ILE . 97.9 m-85 -150.69 127.77 11.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.572 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.481 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 14.4 t -107.21 132.48 53.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.906 0.384 . . . . 0.0 111.326 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.807 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 3.4 m-85 -122.29 172.32 8.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.646 179.615 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -128.67 26.21 5.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.966 179.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -152.94 119.64 5.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.524 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -55.13 -34.0 63.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.017 0.437 . . . . 0.0 110.937 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.06 -55.29 6.71 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.124 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 48.1 t -60.02 -41.15 85.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.969 0.414 . . . . 0.0 110.198 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.608 ' HE1' ' HB1' ' A' ' 50' ' ' ALA . 0.1 OUTLIER -67.76 -37.15 81.72 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.529 179.632 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.424 ' HA ' ' HG2' ' A' ' 101' ' ' LYS . 84.0 m-20 -76.09 -31.3 58.66 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.967 0.413 . . . . 0.0 111.039 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.421 ' O ' ' HB ' ' A' ' 103' ' ' THR . 94.5 m-20 -59.53 -41.35 89.81 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.379 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.633 HG22 HD12 ' A' ' 104' ' ' LEU . 24.5 mm -65.66 -51.89 57.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.504 179.424 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.887 ' HB3' HD11 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -65.32 -27.13 68.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.476 179.516 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.404 ' N ' ' HG3' ' A' ' 101' ' ' LYS . 43.4 mtm -78.43 -40.28 36.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.708 179.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.439 HG22 HD13 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -76.59 -38.83 54.21 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.63 179.846 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 1.064 HD21 HD22 ' A' ' 42' ' ' LEU . 6.5 mt -61.19 -38.98 88.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.572 179.735 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.668 ' HA ' HD12 ' A' ' 108' ' ' ILE . 1.0 OUTLIER -59.0 -32.33 69.61 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.043 0.449 . . . . 0.0 110.427 179.454 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -66.44 -31.24 71.87 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.056 179.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.521 HG21 ' CB ' ' A' ' 42' ' ' LEU . 10.0 mm -69.22 -56.7 10.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.579 179.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.668 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.2 mt -50.66 -61.08 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.542 0 CA-C-O 121.783 0.801 . . . . 0.0 109.662 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.2 m -51.66 -28.9 15.94 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 114.235 -1.348 . . . . 0.0 110.674 179.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.404 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 4.1 mtt-85 -67.33 -40.44 85.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.41 179.483 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.407 ' CZ ' ' HB2' ' A' ' 43' ' ' SER . 86.5 m-85 -84.35 -28.28 27.14 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.382 179.489 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.499 ' CE ' HG22 ' A' ' 108' ' ' ILE . 20.2 mttt . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.497 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.401 ' CB ' ' ND2' ' A' ' 99' ' ' ASN . 11.8 Cg_endo . . . . . 0 N--CA 1.477 0.519 0 CA-C-O 120.909 0.295 . . . . 0.0 111.806 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.3 m -143.26 128.04 18.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.873 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 35.4 m80 63.29 33.58 13.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.287 0.565 . . . . 0.0 111.08 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.529 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 54.9 p 177.59 129.28 0.05 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.637 179.189 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -164.04 114.47 0.6 Allowed Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.598 -0.811 . . . . 0.0 112.335 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.642 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -43.7 100.57 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.165 0.507 . . . . 0.0 111.436 -179.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.821 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -116.54 154.71 29.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.909 -178.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.685 HG23 ' O ' ' A' ' 12' ' ' VAL . 1.0 OUTLIER -101.78 126.63 55.69 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 CA-C-O 121.105 0.479 . . . . 0.0 110.443 178.967 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.499 ' CD1' ' CE2' ' A' ' 89' ' ' PHE . 15.4 t80 -114.0 130.67 56.53 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.208 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.427 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 37.4 mt-10 55.73 35.08 24.63 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.024 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 28.2 mttm 76.24 1.28 3.39 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.394 -179.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.685 ' O ' HG23 ' A' ' 8' ' ' ILE . 42.1 t -99.6 156.68 3.94 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.644 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 178.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.554 ' HA ' HG13 ' A' ' 8' ' ' ILE . 91.1 p -98.86 149.68 22.66 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-O 121.435 0.636 . . . . 0.0 112.408 -178.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.476 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 174.53 -179.53 45.79 Favored Glycine 0 N--CA 1.447 -0.624 0 N-CA-C 110.281 -1.128 . . . . 0.0 110.281 -179.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.642 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.45 142.49 19.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 117.719 0.76 . . . . 0.0 110.493 179.368 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.836 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.63 118.29 54.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 179.784 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -120.19 136.83 54.5 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.17 0.51 . . . . 0.0 111.533 -178.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.695 HG23 HD11 ' A' ' 42' ' ' LEU . 88.5 mt -109.95 140.03 30.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.095 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.8 t-20 -131.29 111.56 11.99 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.915 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -91.54 6.64 44.85 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.275 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 50.8 t0 -79.56 -17.99 52.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.921 0.391 . . . . 0.0 110.333 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -102.78 144.17 14.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.903 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.438 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 70.3 m -116.15 118.89 37.5 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.969 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.438 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 1.8 Cg_endo -80.84 137.88 40.98 Favored 'Cis proline' 0 C--N 1.348 0.519 0 C-N-CA 123.768 -1.347 . . . . 0.0 111.891 -0.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -42.95 140.61 1.33 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.068 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -132.46 167.06 20.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.213 0.53 . . . . 0.0 111.81 -179.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.836 HD21 HG12 ' A' ' 16' ' ' ILE . 5.2 tt -121.11 131.18 54.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.788 179.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 45.2 m -118.75 126.27 51.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.062 0.458 . . . . 0.0 112.047 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.493 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 62.2 t90 -100.43 128.14 46.57 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.814 178.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.452 ' HG2' HG22 ' A' ' 37' ' ' VAL . 0.0 OUTLIER -125.02 118.8 27.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.841 0.353 . . . . 0.0 111.062 -179.843 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.441 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 30.7 t -45.44 167.18 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.314 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.3 -42.78 53.95 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.491 0.662 . . . . 0.0 109.748 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -85.22 -17.83 35.88 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.91 -1.041 . . . . 0.0 111.109 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.74 33.9 12.25 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.359 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -98.83 -22.08 16.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.625 0.25 . . . . 0.0 111.568 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.12 144.11 40.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.989 0.423 . . . . 0.0 111.379 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.452 HG22 ' HG2' ' A' ' 30' ' ' ARG . 42.4 t -139.23 144.06 29.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.758 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.493 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 49.3 t60 -137.27 145.95 44.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.03 0.443 . . . . 0.0 111.415 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.2 m -128.77 137.87 51.78 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.797 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 88.5 t -135.98 140.86 43.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.997 0.427 . . . . 0.0 111.663 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.653 HG22 HG23 ' A' ' 44' ' ' THR . 1.7 p -83.25 117.36 28.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 177.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.941 HD13 HD13 ' A' ' 107' ' ' ILE . 85.8 mt -75.63 -34.27 60.55 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.162 -0.472 . . . . 0.0 112.187 -178.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.422 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 22.4 t -51.07 -24.62 4.07 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.031 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.653 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -85.81 -23.7 27.09 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.816 0.341 . . . . 0.0 111.142 -179.693 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.537 HG12 ' HA ' ' A' ' 42' ' ' LEU . 41.9 mm -47.27 101.5 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.314 -179.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.402 ' N ' ' O ' ' A' ' 63' ' ' ILE . 11.2 t70 -95.25 -20.7 18.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.444 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.523 ' HB2' HG13 ' A' ' 63' ' ' ILE . 46.1 mtmt -153.33 138.58 17.47 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.939 0.399 . . . . 0.0 111.286 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.612 HD21 ' HB3' ' A' ' 104' ' ' LEU . 34.1 mt -109.59 124.35 50.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.899 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.401 ' CB ' ' HB2' ' A' ' 61' ' ' ARG . 25.9 mt-30 -109.91 130.48 55.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.398 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.662 ' HB3' ' HE2' ' A' ' 101' ' ' LYS . . . -145.81 138.95 26.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.097 -179.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 70.0 p -75.76 133.66 73.03 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.549 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.39 149.94 78.2 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.593 2.196 . . . . 0.0 112.443 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.02 -41.68 97.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.142 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 87.3 p -59.29 -26.17 64.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.867 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.9 t -87.73 118.91 27.55 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.874 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -57.7 -18.45 20.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.389 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 30.3 mmtt -65.51 110.07 2.57 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.995 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.464 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 19.0 mmm -94.49 123.9 38.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.44 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.437 ' CE ' ' CE3' ' B' ' 53' ' ' TRP . 11.5 ttm -177.18 160.42 1.73 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.224 0.535 . . . . 0.0 111.994 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.3 tp -148.46 123.91 10.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.86 179.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.401 ' HB2' ' CB ' ' A' ' 49' ' ' GLN . 33.0 mtt180 -116.47 136.68 52.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.141 0.496 . . . . 0.0 112.039 -178.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.424 ' CD1' ' N ' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -111.55 131.0 55.55 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.884 179.02 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.523 HG13 ' HB2' ' A' ' 47' ' ' LYS . 1.0 OUTLIER -109.07 122.14 63.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.128 -179.365 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.58 145.96 17.89 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.354 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.9 mttt -58.62 158.82 7.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.854 0.359 . . . . 0.0 110.959 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.69 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.1 p -121.55 -162.13 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.894 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.69 ' H ' HG22 ' A' ' 66' ' ' VAL . 5.3 m-20 -175.99 55.41 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.33 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -58.3 -21.55 49.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.279 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 35.6 m -59.58 -17.96 37.06 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.061 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -69.05 -38.75 79.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.043 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.3 mptt 59.62 92.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.819 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.423 ' O ' HG22 ' A' ' 80' ' ' VAL . 43.0 mmt180 -95.2 140.87 29.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.991 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 26.1 mmtp -87.6 145.64 26.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.986 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -93.43 172.51 8.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.887 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -60.07 -19.98 55.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.328 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 51.2 mp0 -86.41 4.63 38.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.422 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.62 14.36 82.52 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.699 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -110.45 144.73 38.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.912 0.387 . . . . 0.0 110.948 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -70.96 148.97 47.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.105 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.462 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.1 m -132.21 158.83 43.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.932 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.5 t -102.66 98.62 11.43 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.671 178.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.462 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 85.0 Cg_exo -45.61 161.66 0.12 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.428 2.085 . . . . 0.0 112.546 -179.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -115.0 150.47 44.25 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.054 0.454 . . . . 0.0 110.978 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -72.56 147.41 45.87 Favored 'Trans proline' 0 N--CA 1.465 -0.164 0 C-N-CA 123.466 2.777 . . . . 0.0 112.728 -179.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -72.5 142.36 48.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.796 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.403 ' HG2' HG23 ' A' ' 63' ' ' ILE . 87.0 mtt180 -150.68 119.95 6.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.853 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -105.7 159.06 16.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.671 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.0 ttt -131.74 121.43 24.2 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.929 0.395 . . . . 0.0 111.33 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.646 ' CE2' HD11 ' A' ' 16' ' ' ILE . 91.8 m-85 -128.67 154.0 46.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.505 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 33.1 t -126.68 134.13 50.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.951 0.405 . . . . 0.0 111.141 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.821 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 83.3 m-85 -120.37 162.07 20.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.48 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.464 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 8.9 m120 -109.43 -21.28 12.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.214 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.566 ' HB2' HG23 ' A' ' 96' ' ' VAL . 87.0 m-20 -116.51 112.6 21.61 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.658 179.753 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -48.06 -29.38 3.5 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.02 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.5 -48.92 63.16 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.119 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.566 HG23 ' HB2' ' A' ' 93' ' ' ASN . 52.6 t -58.79 -52.73 56.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.416 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.482 ' HB3' ' CG ' ' A' ' 91' ' ' PHE . 4.0 ptm -62.91 -32.11 73.32 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.464 ' O ' ' HB3' ' A' ' 102' ' ' MET . 12.0 m-20 -63.63 -34.2 77.32 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.182 179.284 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.401 ' ND2' ' CB ' ' A' ' 1' ' ' PRO . 83.5 m-20 -72.05 -44.18 63.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.483 179.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.501 HD12 ' CG2' ' A' ' 16' ' ' ILE . 23.4 mm -60.14 -50.52 79.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.568 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.662 ' HE2' ' HB3' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -61.7 -30.92 71.06 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.939 179.855 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.464 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.1 OUTLIER -79.09 -43.72 23.55 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.506 179.83 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.497 HG21 HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -67.47 -42.69 82.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.849 -179.801 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.818 ' CD2' HD22 ' A' ' 42' ' ' LEU . 35.9 mt -61.7 -39.49 91.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.556 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.519 ' HA ' HD12 ' A' ' 108' ' ' ILE . 36.5 mt-30 -60.86 -32.26 71.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.686 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -68.56 -29.48 68.05 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.812 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.941 HD13 HD13 ' A' ' 42' ' ' LEU . 23.4 mt -77.25 -50.44 20.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.319 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.519 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.3 mt -56.58 -61.1 1.32 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.622 0 CA-C-O 121.749 0.785 . . . . 0.0 109.268 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.6 t -50.56 -28.83 9.37 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.394 -1.275 . . . . 0.0 110.574 179.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 2.2 mtt180 -65.66 -39.83 91.8 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.663 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -85.9 -30.05 23.16 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.592 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.453 ' HE3' HG22 ' A' ' 108' ' ' ILE . 1.6 mttt -63.85 -45.24 90.38 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.465 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -59.86 -37.02 78.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.93 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.06 -33.95 76.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.145 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 22.8 t70 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.865 -179.961 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . 0.605 HD13 ' O ' ' B' ' 45' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.8 0.334 . . . . 0.0 111.164 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.7 m -121.39 161.43 41.27 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.927 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_exo -51.95 -41.42 63.77 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.59 2.193 . . . . 0.0 112.372 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -56.91 -28.12 61.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.984 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -63.64 -47.73 80.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.771 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 40.0 mm -68.62 -27.48 36.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.19 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -65.88 -32.78 74.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.778 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -30.66 69.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.927 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' TRP . . . . . 0.437 ' CE3' ' CE ' ' A' ' 59' ' ' MET . 11.7 m95 -55.71 -32.51 63.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.834 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -82.08 -28.15 32.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.974 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -77.58 -44.96 26.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.777 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 44.5 -166.21 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.462 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -139.81 138.79 20.35 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.792 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo . . . . . 0 C--O 1.25 1.076 0 C-N-CA 122.427 2.084 . . . . 0.0 112.259 -179.965 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo . . . . . 0 N--CA 1.475 0.434 0 CA-C-O 120.777 0.24 . . . . 0.0 111.807 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.0 m -177.68 -39.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.972 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.416 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 58.8 m80 -134.93 35.46 3.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.169 0.509 . . . . 0.0 110.927 -179.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.537 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 58.7 p -178.61 114.96 0.07 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.919 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.424 ' O ' ' C ' ' A' ' 6' ' ' ALA . . . -146.2 113.24 0.67 Allowed Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.946 -0.645 . . . . 0.0 111.978 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.549 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -32.71 121.13 0.34 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.741 0.305 . . . . 0.0 111.327 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.716 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -137.35 149.96 47.38 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -178.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.597 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.2 mp -98.14 124.31 51.14 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.306 0 CA-C-O 121.119 0.485 . . . . 0.0 110.408 179.189 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.502 ' CD1' ' CE2' ' A' ' 89' ' ' PHE . 14.7 t80 -115.85 130.6 56.9 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.069 179.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 58.27 33.71 23.4 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.824 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.1 mttm 75.64 1.34 3.57 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.084 -178.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.485 ' O ' HG23 ' A' ' 8' ' ' ILE . 31.3 t -100.8 149.76 6.04 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.728 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.597 ' HA ' HG13 ' A' ' 8' ' ' ILE . 66.7 p -88.25 145.94 25.6 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.548 -179.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.449 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -175.54 -179.24 45.95 Favored Glycine 0 N--CA 1.442 -0.93 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.668 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.549 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 8.0 mm -106.69 136.32 41.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 CA-C-O 120.792 0.329 . . . . 0.0 110.138 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.652 HG12 HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -106.63 117.81 53.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 178.939 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.483 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -124.18 125.5 44.55 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.239 0.542 . . . . 0.0 111.551 -178.076 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.439 ' CD1' HG22 ' A' ' 103' ' ' THR . 33.7 mt -94.55 139.97 17.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.809 -179.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -131.41 113.76 14.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.031 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -91.01 5.47 48.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.239 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -78.59 -17.96 55.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.937 0.399 . . . . 0.0 110.428 179.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.33 143.96 12.7 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.824 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.422 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 1.4 t -119.61 116.15 33.44 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.966 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.483 ' HB2' ' CB ' ' A' ' 43' ' ' SER . 72.1 Cg_endo -77.39 148.41 87.08 Favored 'Cis proline' 0 C--N 1.348 0.544 0 C-N-CA 123.258 -1.559 . . . . 0.0 112.29 -0.098 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.56 139.37 7.02 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.793 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -130.66 166.98 19.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.192 0.52 . . . . 0.0 111.577 -179.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.652 HD21 HG12 ' A' ' 16' ' ' ILE . 4.8 tt -121.16 128.61 52.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.824 179.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.7 m -116.08 127.2 54.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.065 0.46 . . . . 0.0 111.821 -179.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.496 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 55.3 t90 -100.45 125.15 46.71 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.108 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.834 ' HD2' HG22 ' A' ' 37' ' ' VAL . 14.6 tpt180 -120.92 116.65 25.53 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.589 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 26.3 t -44.54 156.8 0.07 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.675 0.274 . . . . 0.0 110.879 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.449 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -65.94 -39.42 90.48 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 121.586 0.708 . . . . 0.0 109.305 179.866 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -88.16 -20.01 26.18 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.603 -1.18 . . . . 0.0 111.091 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.58 33.48 11.41 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.483 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -97.59 -22.31 16.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.704 0.288 . . . . 0.0 111.525 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.94 145.01 43.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.208 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.834 HG22 ' HD2' ' A' ' 30' ' ' ARG . 38.8 t -139.14 140.0 38.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.185 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.502 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 45.9 t60 -139.61 145.84 39.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.401 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 52.4 m -129.02 138.44 51.92 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.97 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 85.4 t -132.61 140.91 46.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 121.151 0.5 . . . . 0.0 111.846 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.566 HG22 HG23 ' A' ' 44' ' ' THR . 2.1 p -87.42 118.12 32.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.166 178.027 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.994 HD13 HD13 ' A' ' 107' ' ' ILE . 84.3 mt -74.92 -31.77 61.63 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -178.305 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.483 ' CB ' ' HB2' ' A' ' 24' ' ' PRO . 3.2 t -53.74 -24.66 15.62 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.566 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -92.0 -22.41 19.99 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.806 0.336 . . . . 0.0 111.13 -179.791 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.567 HD12 ' HB3' ' A' ' 62' ' ' LEU . 46.4 mm -56.2 91.91 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.11 0.481 . . . . 0.0 110.844 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -63.36 -29.55 70.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.394 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.635 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 0.3 OUTLIER -153.99 157.41 39.06 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.09 0.471 . . . . 0.0 111.587 -179.751 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.632 HD23 ' HG3' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -128.34 127.59 42.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.544 179.138 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.766 ' O ' HD23 ' A' ' 60' ' ' LEU . 96.7 mt-30 -115.99 141.27 48.34 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.006 0.432 . . . . 0.0 111.548 -179.102 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.497 ' HB2' HD21 ' A' ' 60' ' ' LEU . . . -148.12 135.36 20.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.699 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 68.7 p -75.79 131.49 76.48 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.823 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -69.25 160.66 48.97 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.527 2.152 . . . . 0.0 112.404 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.9 -40.56 73.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.159 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 86.0 p -62.75 -26.79 68.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.816 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 41.2 t -75.74 121.7 22.92 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.92 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -56.25 -18.69 11.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.273 179.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.04 154.48 35.65 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.717 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.461 ' HE2' ' O ' ' A' ' 91' ' ' PHE . 63.6 mtp -143.07 79.75 1.66 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.916 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.4 mpp? -155.24 169.1 24.97 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.049 0.452 . . . . 0.0 111.446 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.766 HD23 ' O ' ' A' ' 49' ' ' GLN . 0.2 OUTLIER -132.36 124.24 28.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.989 179.33 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.415 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 2.6 mmt180 -107.83 121.95 45.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.954 0.407 . . . . 0.0 111.846 -179.051 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.567 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -102.7 134.8 45.49 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.141 178.968 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.635 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.3 mm -99.95 150.13 5.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.532 -0.303 . . . . 0.0 111.069 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -115.62 134.28 11.42 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.206 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 25.7 mttt -53.78 139.52 32.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.852 0.358 . . . . 0.0 111.066 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.74 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.4 p -113.3 -161.92 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.956 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.74 ' H ' HG22 ' A' ' 66' ' ' VAL . 0.2 OUTLIER -176.97 67.79 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.141 179.923 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.633 ' OE2' HG11 ' A' ' 66' ' ' VAL . 50.8 mp0 -58.31 -20.87 46.46 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.426 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 27.0 t -58.97 -17.98 29.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.176 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 52.7 mmtt -62.41 -44.02 97.43 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.777 0.323 . . . . 0.0 111.142 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 60.38 92.99 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.774 -179.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 14.1 mtt-85 -106.55 150.6 25.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.989 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.9 mmtt -96.64 149.05 22.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.91 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -96.58 171.66 8.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.866 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -59.68 -20.19 54.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.283 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -86.76 5.96 33.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.389 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.12 15.92 81.06 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.573 -0.823 . . . . 0.0 112.638 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -111.91 145.26 39.85 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.9 0.381 . . . . 0.0 110.943 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -74.04 145.74 44.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.942 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.478 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.2 m -130.53 158.92 42.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.062 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 19.0 t -101.62 98.66 9.9 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.698 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.478 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 80.8 Cg_exo -44.59 145.41 2.69 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.369 2.046 . . . . 0.0 112.651 -179.083 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.449 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 13.1 mtmt -100.67 148.54 35.14 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.953 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 16.8 Cg_exo -72.41 150.52 52.34 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 123.425 2.75 . . . . 0.0 112.654 -178.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -70.89 153.93 42.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.839 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.6 mpp_? -156.5 119.99 4.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.844 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 62.1 m-70 -100.61 155.76 17.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.575 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.527 ' HE1' HD12 ' B' ' 50' ' ' ILE . 23.9 ttt -129.13 125.23 36.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.903 0.382 . . . . 0.0 111.249 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.502 ' CE2' ' CD1' ' A' ' 9' ' ' PHE . 91.9 m-85 -130.86 146.38 52.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.484 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 5.8 t -119.39 133.64 55.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.867 0.365 . . . . 0.0 110.983 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.716 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 2.5 m-85 -125.96 136.35 52.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.82 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 34.2 m-20 -97.1 22.2 8.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.791 0.329 . . . . 0.0 111.076 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -144.99 107.28 4.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.573 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -52.83 -28.82 24.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.071 0.463 . . . . 0.0 111.055 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -77.16 -54.9 5.93 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.303 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 53.4 t -53.87 -46.97 64.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.856 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.66 -35.6 80.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.29 179.514 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -65.86 -32.79 74.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.559 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -66.71 -41.05 88.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.117 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.553 HD12 ' CG2' ' A' ' 16' ' ' ILE . 22.6 mm -66.29 -48.75 80.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.518 179.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.601 ' HB2' HD11 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -66.56 -27.63 67.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.57 179.664 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 40.6 mtm -78.48 -39.08 39.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.616 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.439 HG22 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -80.62 -32.03 36.44 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.658 179.841 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.753 ' HA ' HD12 ' A' ' 107' ' ' ILE . 13.6 mt -65.99 -39.33 90.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.621 179.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.816 ' HA ' HD12 ' A' ' 108' ' ' ILE . 10.6 mt-30 -62.71 -26.83 68.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.883 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -70.33 -43.73 69.69 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.951 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.994 HD13 HD13 ' A' ' 42' ' ' LEU . 4.1 mt -61.86 -47.02 95.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.327 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.911 HG22 ' CD ' ' A' ' 112' ' ' LYS . 2.6 mt -57.43 -60.03 2.58 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.572 0 CA-C-O 121.838 0.828 . . . . 0.0 109.347 179.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.1 m -48.78 -28.92 3.99 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.088 -1.414 . . . . 0.0 111.266 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.47 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 35.3 mtt-85 -69.26 -32.54 71.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.044 0.45 . . . . 0.0 110.809 179.686 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -90.01 -28.8 18.85 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.926 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.911 ' CD ' HG22 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -66.84 -38.31 86.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.881 0.372 . . . . 0.0 110.543 179.568 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -62.13 -37.59 85.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.919 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.89 -33.43 75.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.079 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 89.7 m-20 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.173 -0.918 . . . . 0.0 110.857 179.989 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 74.8 mt . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.813 0.34 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -126.24 157.66 69.26 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.862 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -51.28 -40.43 61.26 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.594 2.196 . . . . 0.0 112.38 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 93.4 m-20 -58.67 -27.68 65.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.96 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -64.55 -42.88 95.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.875 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.527 HD12 ' HE1' ' A' ' 88' ' ' MET . 38.4 mm -66.88 -23.88 31.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.319 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -63.87 -34.68 78.48 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.876 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.46 -30.43 68.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.025 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -55.88 -31.93 63.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.812 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -89.0 -25.31 22.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.972 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.46 -33.25 60.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.817 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -74.97 136.73 41.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.929 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -147.66 161.55 35.02 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.937 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo . . . . . 0 C--O 1.248 0.976 0 C-N-CA 122.553 2.169 . . . . 0.0 112.272 -179.949 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo . . . . . 0 N--CA 1.475 0.396 0 CA-C-O 120.772 0.238 . . . . 0.0 111.785 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.2 t 61.04 114.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.049 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 61.4 m80 64.42 32.5 11.89 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.172 0.511 . . . . 0.0 110.989 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.557 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 77.4 p 177.6 161.73 0.52 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.594 179.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.522 ' CA ' HG13 ' A' ' 96' ' ' VAL . . . 162.78 116.19 0.37 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.296 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.65 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -46.64 103.6 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.192 0.52 . . . . 0.0 111.431 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.833 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -118.87 152.23 36.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.769 -178.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.641 HG23 ' O ' ' A' ' 12' ' ' VAL . 1.0 OUTLIER -99.55 125.25 53.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.072 0.463 . . . . 0.0 110.419 179.009 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.507 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 10.0 t80 -113.34 130.12 56.36 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.132 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 82.5 mt-10 56.85 34.77 25.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.933 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.2 mttm 76.02 1.2 3.44 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.406 -179.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.641 ' O ' HG23 ' A' ' 8' ' ' ILE . 41.5 t -100.31 156.18 4.19 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.617 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.57 ' HA ' HG13 ' A' ' 8' ' ' ILE . 94.1 p -98.19 149.0 23.02 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 121.427 0.632 . . . . 0.0 112.588 -178.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.476 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.16 -179.74 46.24 Favored Glycine 0 N--CA 1.449 -0.493 0 CA-C-N 114.653 -1.158 . . . . 0.0 110.313 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.65 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.59 141.54 21.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 117.615 0.707 . . . . 0.0 110.406 179.344 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.846 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.63 118.45 54.37 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.737 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 179.565 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.486 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -120.99 131.19 54.15 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.17 0.51 . . . . 0.0 111.546 -178.467 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.77 HG23 HD11 ' A' ' 42' ' ' LEU . 90.3 mt -106.08 138.57 30.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.056 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -131.32 117.18 18.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.149 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -93.63 4.93 53.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.189 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -79.12 -17.59 54.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.959 0.409 . . . . 0.0 110.318 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.22 141.22 17.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.873 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.484 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.0 t -114.28 116.33 44.33 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.825 179.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.484 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 1.2 Cg_endo -81.43 142.95 56.86 Favored 'Cis proline' 0 C--N 1.349 0.589 0 C-N-CA 123.807 -1.33 . . . . 0.0 111.934 0.102 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -45.33 141.64 2.47 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.142 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -136.59 167.15 21.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.158 0.504 . . . . 0.0 111.626 -179.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.846 HD21 HG12 ' A' ' 16' ' ' ILE . 5.1 tt -121.19 129.2 53.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.818 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.7 m -117.43 126.21 52.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.159 0.504 . . . . 0.0 112.177 -178.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.479 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 59.8 t90 -100.51 128.88 46.44 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.937 179.008 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 26.3 ttt180 -124.58 116.78 22.99 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.81 0.338 . . . . 0.0 111.069 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.476 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 16.3 m -46.11 168.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.125 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -42.07 61.72 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 121.48 0.657 . . . . 0.0 109.555 179.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -85.22 -20.19 30.52 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.832 -1.076 . . . . 0.0 111.03 179.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.01 33.26 11.09 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.513 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 51.9 t0 -100.55 -23.1 14.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.655 0.264 . . . . 0.0 111.425 -179.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.427 ' CE ' HG21 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -129.88 135.67 48.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.995 -179.947 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 12.7 p -139.12 130.32 34.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.143 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.507 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 51.3 t60 -129.43 145.79 51.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.022 0.439 . . . . 0.0 111.291 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 46.1 m -129.07 135.05 48.39 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.965 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 98.7 t -126.26 140.87 47.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.161 0.505 . . . . 0.0 111.513 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.577 HG22 HG23 ' A' ' 44' ' ' THR . 2.1 p -85.51 117.55 30.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 1.058 HD13 HD13 ' A' ' 107' ' ' ILE . 72.5 mt -75.37 -29.66 59.96 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.995 -178.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.448 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 9.7 t -56.14 -21.71 24.22 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.225 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.577 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -96.8 -21.89 17.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.699 0.285 . . . . 0.0 111.186 -179.794 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.761 HD12 ' HB3' ' A' ' 62' ' ' LEU . 38.0 mm -56.64 90.59 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.049 0.452 . . . . 0.0 110.89 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -71.06 -27.25 63.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.604 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.74 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 20.7 mttm -144.74 152.39 40.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.013 0.435 . . . . 0.0 111.629 -179.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.621 HD23 ' HG2' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -132.69 131.13 40.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.988 179.345 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.403 ' O ' HD23 ' A' ' 60' ' ' LEU . 94.1 mt-30 -125.9 143.78 50.94 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.95 -179.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.603 ' HB1' ' CE ' ' A' ' 97' ' ' MET . . . -145.26 145.94 31.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.979 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.454 HG23 ' CE2' ' B' ' 54' ' ' PHE . 42.5 p -75.7 128.26 84.06 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.505 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -61.41 154.16 60.91 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.573 2.182 . . . . 0.0 112.467 -179.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.87 -40.51 97.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.173 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 85.3 p -59.44 -26.8 65.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.859 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 29.5 m -86.32 117.37 25.08 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.843 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -56.38 -18.65 11.67 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.596 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.8 mmtm -71.83 124.0 23.88 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.029 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 27.3 mmm -104.15 118.9 37.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.498 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.447 ' HE1' ' CE3' ' B' ' 53' ' ' TRP . 2.4 ttm -175.75 161.62 2.58 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.176 0.512 . . . . 0.0 112.006 -179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.403 HD23 ' O ' ' A' ' 49' ' ' GLN . 1.4 tt -153.59 123.94 7.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.756 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 29.8 ttp180 -117.94 138.03 52.44 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.761 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -112.44 136.17 52.26 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.259 179.291 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.74 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.3 mm -103.29 133.79 46.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.816 0.341 . . . . 0.0 111.142 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -101.93 134.07 11.61 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.076 179.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 40.1 mttt -44.1 137.5 3.35 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.942 0.401 . . . . 0.0 111.286 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.722 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.2 p -105.2 -162.13 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.009 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.722 ' H ' HG22 ' A' ' 66' ' ' VAL . 52.1 t0 -173.55 68.99 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.261 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -56.0 -22.21 25.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.398 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.4 m -58.2 -18.87 29.04 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.907 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.7 mtmt -69.57 -42.62 74.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.981 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.7 mttt 60.26 92.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.866 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -92.03 137.9 31.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.873 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 28.8 mmtm -89.16 145.29 25.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.897 0.38 . . . . 0.0 110.893 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -93.29 171.95 8.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.883 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 40.7 t-20 -59.43 -20.53 55.74 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.301 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 50.7 mp0 -86.41 3.44 43.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.359 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.07 14.29 82.05 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.709 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -110.08 144.43 38.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.909 0.385 . . . . 0.0 110.969 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -70.73 147.26 49.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.094 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.432 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.8 m -140.48 158.65 24.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.028 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 20.3 t -83.64 110.19 23.23 Favored Pre-proline 0 C--N 1.326 -0.444 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.432 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 86.1 Cg_exo -46.2 145.26 5.7 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.196 1.931 . . . . 0.0 112.622 -178.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.519 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 8.5 mmtm -83.09 99.3 0.64 Allowed Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.126 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.519 ' HD2' ' HA ' ' A' ' 83' ' ' LYS . 1.3 Cg_endo -40.77 149.61 0.16 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 123.433 2.755 . . . . 0.0 112.598 179.165 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -65.38 139.64 58.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.776 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 12.0 mtp180 -150.5 120.02 6.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.868 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -103.48 143.49 32.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.579 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 23.7 ttt -118.55 131.91 56.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.231 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.57 ' CE1' HD11 ' A' ' 16' ' ' ILE . 94.1 m-85 -139.2 144.39 38.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.645 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 1.5 m -125.17 135.1 52.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.074 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.833 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 2.1 m-85 -123.22 172.5 8.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.532 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 69.9 m-20 -126.74 26.9 6.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.005 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -157.3 121.77 4.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.607 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 32.9 mmt-85 -56.1 -36.18 67.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.026 0.441 . . . . 0.0 110.76 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.14 -55.17 15.32 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.919 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.522 HG13 ' CA ' ' A' ' 5' ' ' GLY . 55.3 t -61.13 -40.75 86.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.105 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.603 ' CE ' ' HB1' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -69.31 -34.78 75.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.312 179.628 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.47 ' O ' ' HG2' ' A' ' 101' ' ' LYS . 67.3 m-20 -76.14 -31.02 58.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.08 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -62.23 -36.27 81.46 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.313 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.519 HD12 ' CG2' ' A' ' 16' ' ' ILE . 22.1 mm -70.57 -49.15 54.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.957 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.555 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 4.4 pttt -64.8 -27.51 68.93 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.923 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.456 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.1 OUTLIER -78.55 -41.91 30.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.109 179.564 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.488 HG21 HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -71.4 -41.4 69.66 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.641 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.682 ' HA ' HD12 ' A' ' 107' ' ' ILE . 13.9 mt -60.31 -41.1 92.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.801 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.761 ' HA ' HD12 ' A' ' 108' ' ' ILE . 1.5 mt-30 -61.87 -30.23 70.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.939 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -68.48 -36.27 78.7 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.118 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.058 HD13 HD13 ' A' ' 42' ' ' LEU . 6.6 mt -70.72 -46.65 68.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.476 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.87 HG22 ' HD3' ' A' ' 112' ' ' LYS . 2.5 mt -57.48 -61.09 1.42 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 CA-C-O 121.803 0.811 . . . . 0.0 109.385 179.157 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.4 p -50.28 -31.71 14.98 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.199 -1.364 . . . . 0.0 110.91 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 52.5 mtt-85 -68.63 -33.53 74.17 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.832 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.508 ' CE2' HG22 ' A' ' 107' ' ' ILE . 20.1 m-85 -92.19 -33.92 14.51 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.921 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.87 ' HD3' HG22 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -65.02 -36.55 84.76 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.788 179.784 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -61.77 -37.02 82.75 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.936 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.06 -42.77 96.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.202 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 53.3 p30 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.945 -179.96 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 25.6 tp . . . . . 0 N--CA 1.485 1.312 0 CA-C-O 120.848 0.356 . . . . 0.0 111.295 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.7 m -124.61 164.21 32.06 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.831 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_exo -51.67 -43.24 52.15 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.577 2.185 . . . . 0.0 112.321 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -59.41 -28.0 66.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.964 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -62.24 -43.4 98.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.76 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 36.5 mm -67.69 -26.67 35.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.238 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -64.63 -33.79 76.75 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.933 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -32.91 74.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.671 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' TRP . . . . . 0.447 ' CE3' ' HE1' ' A' ' 59' ' ' MET . 11.4 m0 -57.26 -41.89 80.51 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.892 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' PHE . . . . . 0.454 ' CE2' HG23 ' A' ' 51' ' ' THR . 73.6 m-85 -68.0 -28.62 67.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.942 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -80.78 -38.32 28.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.855 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -59.72 139.99 56.83 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.898 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -141.03 163.44 42.33 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.914 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo . . . . . 0 C--O 1.25 1.101 0 C-N-CA 122.531 2.154 . . . . 0.0 112.287 179.949 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo . . . . . 0 N--CA 1.478 0.575 0 CA-C-O 120.791 0.246 . . . . 0.0 111.75 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.0 m -169.26 -60.96 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.951 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 64.2 m80 -126.43 33.27 5.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.15 0.5 . . . . 0.0 110.924 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.539 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 62.9 p 179.14 115.73 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.889 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.425 ' O ' ' C ' ' A' ' 6' ' ' ALA . . . -146.64 113.45 0.67 Allowed Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.929 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.552 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -32.93 120.09 0.34 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.769 0.319 . . . . 0.0 111.269 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.538 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -136.28 151.32 49.52 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -178.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.593 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.2 mp -98.54 125.36 51.92 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.27 0 CA-C-O 121.063 0.458 . . . . 0.0 110.523 179.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.504 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 7.4 t80 -117.05 130.13 56.47 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.015 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 58.58 33.81 23.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.814 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 69.8 mttt 75.46 1.6 3.66 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.149 -178.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.467 ' O ' HG23 ' A' ' 8' ' ' ILE . 31.3 t -101.44 148.4 7.34 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.745 0 CA-C-N 116.031 -0.532 . . . . 0.0 109.63 179.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.593 ' HA ' HG13 ' A' ' 8' ' ' ILE . 78.7 p -86.83 146.21 26.3 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-O 121.446 0.641 . . . . 0.0 111.523 -179.368 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.444 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . -175.6 -179.1 45.92 Favored Glycine 0 N--CA 1.441 -0.984 0 CA-C-N 115.056 -0.975 . . . . 0.0 111.764 -179.528 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.552 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 7.0 mm -106.21 136.01 42.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 120.849 0.357 . . . . 0.0 110.062 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.695 HG12 HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -106.6 117.85 53.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.836 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.475 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -123.61 132.13 53.79 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.337 0.589 . . . . 0.0 111.596 -178.049 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.469 HD13 HG22 ' A' ' 103' ' ' THR . 46.1 mt -102.46 133.0 47.36 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.058 -179.409 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -124.35 114.18 19.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.012 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -88.35 5.61 41.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.251 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -78.37 -18.23 55.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.911 0.386 . . . . 0.0 110.358 179.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -98.07 145.43 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.904 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.413 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 1.2 t -121.81 116.25 30.37 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.991 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.489 ' HG2' HG23 ' A' ' 41' ' ' VAL . 72.1 Cg_endo -76.22 149.79 92.35 Favored 'Cis proline' 0 C--N 1.35 0.612 0 C-N-CA 123.211 -1.579 . . . . 0.0 112.108 -0.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.14 137.56 5.96 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.801 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -128.35 164.18 23.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.148 0.499 . . . . 0.0 111.803 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.695 HD21 HG12 ' A' ' 16' ' ' ILE . 4.8 tt -121.12 129.19 53.18 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.696 179.262 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.0 m -116.5 129.0 55.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.137 0.494 . . . . 0.0 111.902 -179.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.499 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 57.8 t90 -100.37 125.68 46.66 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.139 179.083 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.19 116.51 23.52 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.638 179.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.403 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 11.2 m -44.42 158.36 0.05 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.704 0.288 . . . . 0.0 110.975 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.425 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -66.34 -39.45 89.22 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.494 0.664 . . . . 0.0 109.263 179.974 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 48.0 p30 -85.51 -20.8 29.13 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.213 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.77 32.71 12.4 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.649 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -99.5 -23.56 15.06 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.839 0.352 . . . . 0.0 111.467 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.3 mtmt -130.12 142.42 50.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.07 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 14.4 p -139.04 136.71 42.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.22 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.504 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 82.0 t60 -136.39 146.34 46.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.007 0.432 . . . . 0.0 111.347 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 43.5 m -127.47 136.95 52.5 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.951 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 92.6 t -132.38 140.87 46.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-O 121.018 0.437 . . . . 0.0 111.599 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.682 HG13 ' CG2' ' A' ' 44' ' ' THR . 0.8 OUTLIER -87.75 118.15 32.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 178.026 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 1.043 HD13 HD13 ' A' ' 107' ' ' ILE . 46.6 mt -71.61 -29.7 64.97 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -178.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.455 ' CB ' ' HB2' ' A' ' 24' ' ' PRO . 1.5 t -55.51 -22.22 20.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.671 0.272 . . . . 0.0 111.684 -179.39 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.682 ' CG2' HG13 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -88.69 -24.96 22.6 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.786 0.327 . . . . 0.0 111.252 -179.653 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.79 HD12 ' HB3' ' A' ' 62' ' ' LEU . 50.5 mm -56.04 91.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.064 0.459 . . . . 0.0 111.021 -179.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 63' ' ' ILE . 7.1 t0 -78.59 -25.82 45.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.598 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.408 ' HB2' HG13 ' A' ' 63' ' ' ILE . 7.2 mmmt -148.32 148.59 30.58 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.053 0.454 . . . . 0.0 111.518 -179.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.775 HD11 ' HB3' ' A' ' 104' ' ' LEU . 41.2 mt -115.68 124.37 50.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.498 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -115.15 137.84 51.57 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.76 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.739 ' HB2' ' CD1' ' A' ' 60' ' ' LEU . . . -145.89 151.27 37.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.014 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 55.1 p -75.72 130.31 79.3 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.58 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.32 158.46 44.64 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.583 2.189 . . . . 0.0 112.489 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.59 -43.0 97.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.066 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.1 m -59.35 -27.59 66.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.072 0.463 . . . . 0.0 110.822 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 31.5 t -82.31 119.55 24.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.896 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -57.18 -18.27 14.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.44 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.404 ' HD2' ' CE3' ' B' ' 53' ' ' TRP . 35.8 mmtm -60.45 155.85 17.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.854 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 17.3 mtp -143.02 79.9 1.66 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.794 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.429 ' CE ' ' CE3' ' B' ' 53' ' ' TRP . 0.2 OUTLIER -147.55 167.22 25.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.061 0.458 . . . . 0.0 111.63 -179.669 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.739 ' CD1' ' HB2' ' A' ' 50' ' ' ALA . 13.2 tp -136.46 128.66 29.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.034 179.458 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -114.26 122.03 45.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.945 0.402 . . . . 0.0 111.788 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.79 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.3 OUTLIER -97.24 139.6 32.97 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.924 179.014 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.507 HD13 ' HG2' ' A' ' 86' ' ' ARG . 0.9 OUTLIER -115.66 119.22 61.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.017 -179.686 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -89.49 151.77 22.13 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.248 179.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.8 mttm -59.06 135.51 57.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.805 0.336 . . . . 0.0 110.762 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.786 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.3 p -79.62 -167.55 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.169 0.509 . . . . 0.0 111.193 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.786 ' H ' HG22 ' A' ' 66' ' ' VAL . 54.2 p-10 -148.44 59.51 1.08 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.638 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -56.01 -22.55 27.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.387 -179.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.4 t -59.62 -17.52 34.07 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.015 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.8 mmtp -71.01 -50.68 31.51 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.761 0.315 . . . . 0.0 111.092 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.4 mmtm 63.43 95.22 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.712 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 31.6 mmt180 -99.65 168.64 9.8 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.804 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 7.9 mttt -124.91 146.69 49.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.96 0.409 . . . . 0.0 111.08 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -86.28 171.93 10.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.8 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -62.15 -18.11 59.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.343 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -85.95 4.38 37.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.569 0.223 . . . . 0.0 111.425 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 83.54 3.22 89.87 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.78 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.402 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 24.2 p30 -91.26 168.14 11.81 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.738 0.304 . . . . 0.0 110.763 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -94.89 153.38 17.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.851 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.44 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.2 m -138.18 158.9 32.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.969 0.414 . . . . 0.0 111.222 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 38.5 t -101.93 98.74 10.52 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.563 178.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.44 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 93.5 Cg_exo -42.81 145.34 1.12 Allowed 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.537 2.158 . . . . 0.0 112.779 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.449 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 11.4 mttp -84.35 148.58 53.01 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.054 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.578 ' HA ' HG23 ' A' ' 66' ' ' VAL . 16.4 Cg_exo -73.06 162.4 40.96 Favored 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 123.509 2.806 . . . . 0.0 112.741 -178.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -65.45 144.03 57.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.802 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.507 ' HG2' HD13 ' A' ' 63' ' ' ILE . 32.9 mtp180 -145.12 119.92 9.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.935 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 58.2 m-70 -107.4 159.11 16.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.61 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.1 ttt -130.44 132.03 45.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.029 0.442 . . . . 0.0 111.345 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.663 ' CE2' HD11 ' A' ' 16' ' ' ILE . 87.6 m-85 -138.62 145.99 41.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.459 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -118.96 133.87 55.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.809 0.338 . . . . 0.0 111.1 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.502 ' N ' ' CD1' ' A' ' 91' ' ' PHE . 1.4 m-85 -127.5 158.24 37.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.573 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 53.5 m-20 -115.79 25.53 10.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.936 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.478 ' HB3' HG23 ' A' ' 96' ' ' VAL . 47.3 t-20 -156.68 108.03 2.42 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.487 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 8.9 tpp180 -46.86 -29.87 2.21 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.005 0.431 . . . . 0.0 111.288 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.2 -54.0 9.54 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.537 -179.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.478 HG23 ' HB3' ' A' ' 93' ' ' ASN . 58.1 t -53.63 -49.66 54.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.827 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.432 ' HB3' ' CG ' ' A' ' 91' ' ' PHE . 18.7 ptm -63.98 -37.22 86.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.0 0.429 . . . . 0.0 110.064 179.386 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -66.38 -31.2 71.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.511 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -67.89 -40.46 83.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.931 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.67 HG22 HD12 ' A' ' 104' ' ' LEU . 24.7 mm -66.43 -49.77 72.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.423 179.273 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 3.9 pttt -66.01 -27.28 68.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.46 179.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 64.6 mtp -78.25 -40.19 37.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.542 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.469 HG22 HD13 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -79.11 -37.18 39.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.514 179.735 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.807 ' HA ' HD12 ' A' ' 107' ' ' ILE . 12.0 mt -61.59 -39.56 91.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.767 179.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.756 ' HA ' HD12 ' A' ' 108' ' ' ILE . 1.0 OUTLIER -61.65 -29.1 69.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.878 179.874 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 99.6 mm-40 -69.23 -33.8 73.83 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.811 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.043 HD13 HD13 ' A' ' 42' ' ' LEU . 4.0 mt -72.52 -44.48 61.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.308 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.87 HG22 ' HD3' ' A' ' 112' ' ' LYS . 2.6 mt -58.84 -61.18 1.52 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.551 0 CA-C-O 121.764 0.792 . . . . 0.0 109.474 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.1 t -50.91 -28.84 10.51 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.16 -1.382 . . . . 0.0 110.943 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 49.3 mtt180 -70.32 -33.7 71.82 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.762 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.477 ' CE2' HG22 ' A' ' 107' ' ' ILE . 19.9 m-85 -92.32 -35.33 13.8 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.938 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.87 ' HD3' HG22 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -63.68 -40.53 97.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.741 179.802 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -60.34 -37.13 79.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.878 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.73 -32.93 74.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.068 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 43.1 t0 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.163 -0.922 . . . . 0.0 111.277 179.824 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . 0.502 HD23 ' O ' ' B' ' 45' ' ' LEU . 7.0 tt . . . . . 0 N--CA 1.485 1.304 0 CA-C-O 120.83 0.347 . . . . 0.0 111.226 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 5.7 t -124.47 152.2 68.06 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.751 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -48.6 -39.86 37.58 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.606 2.204 . . . . 0.0 112.324 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -62.06 -27.14 68.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.696 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -64.75 -45.62 85.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.861 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 31.2 mm -66.33 -26.67 38.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.215 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -65.47 -33.73 76.63 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.915 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.36 -28.56 67.23 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.204 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' TRP . . . . . 0.429 ' CE3' ' CE ' ' A' ' 59' ' ' MET . 11.5 m0 -54.26 -29.2 46.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.842 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -97.51 -24.94 15.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.976 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -81.07 -29.65 34.91 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.793 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 45.0 -166.39 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.367 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -123.46 78.41 54.39 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.901 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo . . . . . 0 C--O 1.249 1.037 0 C-N-CA 122.507 2.138 . . . . 0.0 112.313 -179.999 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo . . . . . 0 N--CA 1.477 0.512 0 CA-C-O 120.801 0.25 . . . . 0.0 111.862 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.2 t 61.22 -83.08 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.163 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.449 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 55.1 m80 -117.37 37.9 3.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.982 0.42 . . . . 0.0 111.265 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.521 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 1.2 m -166.68 176.62 7.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.671 179.258 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 159.08 126.09 0.84 Allowed Glycine 0 N--CA 1.444 -0.814 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.321 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.606 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -53.65 111.65 0.77 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.018 0.437 . . . . 0.0 111.192 -179.689 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.631 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -125.81 150.27 47.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.831 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.551 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -100.14 125.78 53.8 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.267 0 CA-C-O 120.979 0.418 . . . . 0.0 110.222 179.049 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.507 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 6.1 t80 -112.93 131.16 55.85 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.284 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.0 mt-10 55.07 34.25 22.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.859 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.0 mttp 76.44 0.8 3.26 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.365 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.527 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.4 t -98.78 154.25 4.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 178.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.551 ' HA ' HG13 ' A' ' 8' ' ' ILE . 83.6 p -96.32 149.0 22.17 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 121.721 0.772 . . . . 0.0 112.742 -178.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.469 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.7 -179.69 46.72 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 114.449 -1.25 . . . . 0.0 110.292 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.606 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.71 144.35 15.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 117.673 0.736 . . . . 0.0 110.529 179.36 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.825 HG12 HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -106.81 118.55 54.77 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 CA-C-N 115.358 -0.837 . . . . 0.0 108.835 179.577 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.521 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -121.14 132.31 54.78 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.355 -178.689 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.514 ' CG1' HD12 ' A' ' 27' ' ' LEU . 59.3 mt -104.08 140.1 23.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.074 -179.163 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -132.51 111.46 11.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.862 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -90.36 5.2 48.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.325 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -78.9 -17.76 55.02 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.954 0.406 . . . . 0.0 110.36 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.62 142.97 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.947 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.426 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.5 t -115.81 116.77 40.47 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.834 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.426 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 2.1 Cg_endo -80.08 144.65 69.92 Favored 'Cis proline' 0 C--N 1.348 0.534 0 C-N-CA 123.707 -1.372 . . . . 0.0 111.933 0.142 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.78 139.58 5.25 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.886 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -133.49 167.27 20.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.088 0.47 . . . . 0.0 111.661 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.825 HD21 HG12 ' A' ' 16' ' ' ILE . 5.6 tt -120.97 128.78 53.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.639 179.348 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.3 m -114.74 127.48 55.77 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.208 0.528 . . . . 0.0 112.085 -178.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.496 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 56.3 t90 -100.43 128.8 46.39 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.8 179.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 14.6 tpt180 -123.51 116.04 22.52 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.79 0.329 . . . . 0.0 110.976 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.469 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 30.9 t -45.37 164.36 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.062 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.41 -41.56 66.12 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.482 0.658 . . . . 0.0 109.507 179.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -82.32 -22.17 35.72 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.792 -1.094 . . . . 0.0 111.027 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.72 32.99 10.42 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.458 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -106.82 -20.18 13.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.712 0.291 . . . . 0.0 111.433 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.487 ' HE2' HG21 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -129.46 135.0 48.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.799 0.333 . . . . 0.0 111.109 -179.814 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 13.2 p -139.15 138.93 40.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.042 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.507 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 77.5 t60 -136.81 146.24 45.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.082 0.468 . . . . 0.0 111.364 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 48.2 m -127.15 132.77 50.46 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.073 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 95.7 t -124.32 140.87 46.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.457 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.61 HG22 HG23 ' A' ' 44' ' ' THR . 2.1 p -85.2 117.33 30.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 178.1 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 1.031 HD13 HD13 ' A' ' 107' ' ' ILE . 68.5 mt -75.7 -30.42 59.33 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.124 -178.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.409 ' HB3' ' HB3' ' A' ' 24' ' ' PRO . 60.5 p -56.12 -21.74 24.2 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -179.004 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.61 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -93.91 -24.73 17.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.742 0.306 . . . . 0.0 111.287 -179.704 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.829 HD12 ' HB3' ' A' ' 62' ' ' LEU . 42.7 mm -51.17 93.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.983 0.421 . . . . 0.0 110.918 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -77.54 -27.68 51.7 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.511 -179.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.61 ' CE ' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -140.3 159.15 42.83 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 121.201 0.524 . . . . 0.0 111.381 -179.298 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.748 HD11 ' HB3' ' A' ' 104' ' ' LEU . 27.4 mt -126.89 124.24 39.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.953 178.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.432 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 79.9 mt-30 -120.81 136.9 54.78 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.977 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.402 ' HB2' ' HG ' ' A' ' 60' ' ' LEU . . . -148.23 151.23 35.12 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.115 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 60.5 p -75.56 126.82 87.01 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.44 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -59.51 155.85 39.61 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.55 2.167 . . . . 0.0 112.515 -179.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.48 -43.08 97.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.091 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 93.6 p -59.59 -27.62 66.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.038 0.447 . . . . 0.0 110.722 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 26.3 t -80.62 120.9 25.16 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.954 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -56.65 -18.48 12.35 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.334 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.416 ' HD2' ' CE3' ' B' ' 53' ' ' TRP . 30.4 mmtt -66.79 156.49 35.38 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.872 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.496 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 31.7 mtp -143.0 89.89 2.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.743 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.466 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 44.3 mtm -155.74 156.36 34.72 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.052 0.453 . . . . 0.0 111.817 -179.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.553 HD11 ' HD2' ' A' ' 101' ' ' LYS . 0.1 OUTLIER -131.61 123.9 28.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.38 179.707 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.432 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 39.0 mtp180 -107.82 127.08 53.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.847 0.355 . . . . 0.0 111.333 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.829 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -111.04 123.45 50.22 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.943 -179.929 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.61 HD13 ' CE ' ' A' ' 47' ' ' LYS . 3.9 mp -109.64 136.04 46.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.831 0.348 . . . . 0.0 111.136 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.9 -169.42 38.21 Favored Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.378 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.91 143.43 34.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.759 0.314 . . . . 0.0 110.807 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.747 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.3 p -99.97 -162.25 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.045 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.747 ' H ' HG22 ' A' ' 66' ' ' VAL . 14.3 t70 -175.14 70.97 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.254 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.558 ' OE1' HG12 ' A' ' 81' ' ' VAL . 52.7 mm-40 -56.9 -20.61 24.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.492 -179.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 27.1 t -57.51 -18.59 19.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.206 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.3 mmmt -57.76 -46.77 84.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.068 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? 62.29 94.32 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.856 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 57.7 mmm-85 -107.64 154.92 20.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.822 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -119.11 145.33 46.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.908 0.385 . . . . 0.0 111.041 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -84.85 171.27 12.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.865 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -61.97 -18.09 59.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.384 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -85.41 4.67 34.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.551 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 81.61 6.57 89.02 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.722 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -94.23 162.07 14.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.707 0.289 . . . . 0.0 110.681 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -94.97 151.83 18.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.938 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.459 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.3 m -135.41 158.93 40.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.15 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.558 HG12 ' OE1' ' A' ' 68' ' ' GLU . 19.4 t -101.05 98.73 9.13 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.708 178.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.459 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 92.1 Cg_exo -42.81 145.52 1.07 Allowed 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.562 2.175 . . . . 0.0 112.845 -179.005 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.411 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 2.6 tttt -104.48 150.84 38.93 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.715 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 16.9 Cg_exo -72.43 147.14 46.09 Favored 'Trans proline' 0 N--CA 1.464 -0.207 0 C-N-CA 123.524 2.816 . . . . 0.0 112.699 -178.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -65.63 133.73 51.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.905 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.52 ' HG2' ' CG1' ' A' ' 63' ' ' ILE . 10.4 mtm180 -123.94 124.43 42.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.767 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -93.49 159.15 15.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.554 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 25.4 ttt -133.45 128.99 36.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.87 0.367 . . . . 0.0 111.381 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.623 ' CE1' HD11 ' A' ' 16' ' ' ILE . 97.9 m-85 -139.68 148.99 43.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.603 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.466 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 2.8 t -125.64 124.17 40.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.841 0.353 . . . . 0.0 110.937 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.631 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 3.8 m-85 -112.44 170.61 8.05 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.914 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.496 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 27.7 p30 -128.76 26.09 5.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.146 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.4 ' CB ' HG23 ' A' ' 96' ' ' VAL . 84.8 m-20 -153.53 112.05 3.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.65 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.71 -33.0 63.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.208 0.528 . . . . 0.0 110.902 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.19 -49.64 54.81 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.162 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.4 HG23 ' CB ' ' A' ' 93' ' ' ASN . 47.9 t -58.89 -40.64 80.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.556 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.438 ' SD ' HD12 ' A' ' 60' ' ' LEU . 0.6 OUTLIER -63.48 -33.56 75.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.431 179.508 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -65.44 -35.4 80.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.741 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -69.28 -41.19 77.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.806 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.445 HG22 HD12 ' A' ' 104' ' ' LEU . 21.5 mm -62.76 -52.02 64.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.738 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.553 ' HD2' HD11 ' A' ' 60' ' ' LEU . 5.6 mtpp -64.55 -27.87 69.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.723 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 36.3 mtm -78.42 -36.88 45.06 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.062 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.512 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.5 OUTLIER -82.06 -38.96 24.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.009 -179.792 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.836 ' CD2' HD22 ' A' ' 42' ' ' LEU . 16.2 mt -64.08 -39.67 94.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.841 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.711 ' HA ' HD12 ' A' ' 108' ' ' ILE . 2.3 mt-30 -64.46 -29.34 70.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.865 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -69.37 -31.64 70.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.921 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.031 HD13 HD13 ' A' ' 42' ' ' LEU . 5.9 mt -74.89 -46.43 40.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.282 -179.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.711 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.2 mt -58.22 -61.24 1.44 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.589 0 CA-C-O 121.689 0.757 . . . . 0.0 109.343 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.5 m -50.53 -28.91 9.39 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.325 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.92 -41.56 97.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.449 179.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 75.5 m-85 -83.64 -29.65 27.51 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.344 179.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.473 ' CE ' HG22 ' A' ' 108' ' ' ILE . 18.9 mttt -63.03 -43.3 99.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.502 179.455 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -59.34 -38.05 79.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.859 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.41 -32.59 74.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.134 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 51.9 t0 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.328 -0.844 . . . . 0.0 110.893 179.99 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . 0.655 HD13 ' N ' ' B' ' 45' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.838 0.351 . . . . 0.0 111.341 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.1 m -130.1 167.49 20.49 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.912 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -50.74 -46.22 31.28 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.572 2.182 . . . . 0.0 112.487 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -63.49 -31.74 72.98 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.895 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -64.88 -40.97 95.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.893 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 35.2 mm -68.12 -24.24 29.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.363 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -63.17 -35.55 80.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.827 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' GLN . . . . . 0.433 ' HG2' ' CD1' ' B' ' 53' ' ' TRP . 4.9 pt20 -58.19 -41.27 83.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.13 0.49 . . . . 0.0 110.872 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' TRP . . . . . 0.433 ' CD1' ' HG2' ' B' ' 52' ' ' GLN . 47.9 m95 -56.62 -29.92 62.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.112 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -108.15 -0.7 20.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.205 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -99.05 -29.7 12.74 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 120.706 0.289 . . . . 0.0 110.945 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -58.98 139.62 56.57 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.994 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -142.08 164.92 30.8 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.855 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo . . . . . 0 C--O 1.248 1.019 0 C-N-CA 122.54 2.16 . . . . 0.0 112.282 -179.98 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo . . . . . 0 N--CA 1.476 0.469 0 CA-C-O 120.857 0.274 . . . . 0.0 111.817 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.0 t 60.75 112.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.932 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 52.8 m80 62.19 32.6 17.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.218 0.533 . . . . 0.0 110.876 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.589 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 75.1 p 178.11 162.41 0.63 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.572 179.177 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.419 ' CA ' HG13 ' A' ' 96' ' ' VAL . . . 161.6 116.27 0.39 Allowed Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.716 -0.755 . . . . 0.0 112.535 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.639 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -46.88 102.87 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.104 0.478 . . . . 0.0 111.298 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.823 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -117.64 151.79 36.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.931 -178.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.556 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.9 OUTLIER -98.78 123.88 51.65 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.26 0 CA-C-O 121.101 0.477 . . . . 0.0 110.373 178.918 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.504 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 14.3 t80 -112.26 130.17 56.02 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.045 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 56.52 34.35 24.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.731 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.8 mtpm? 75.88 1.7 3.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.287 -179.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.511 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.8 t -100.8 154.57 4.56 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.596 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.001 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.556 ' HA ' HG13 ' A' ' 8' ' ' ILE . 89.5 p -95.66 149.42 21.48 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 121.549 0.69 . . . . 0.0 112.646 -178.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.465 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 174.54 -179.73 45.68 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 114.645 -1.161 . . . . 0.0 110.41 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.639 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.83 141.91 20.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 117.795 0.797 . . . . 0.0 110.579 179.426 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.865 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.77 118.48 54.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 179.62 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.5 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -121.83 130.44 53.39 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.525 -178.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.862 HG23 HD11 ' A' ' 42' ' ' LEU . 77.2 mt -101.45 129.7 52.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.12 -179.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 51.6 t30 -116.1 111.44 20.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.034 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -89.75 7.03 38.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.165 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -78.94 -18.47 53.74 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.852 0.358 . . . . 0.0 110.384 179.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.502 ' CG2' ' N ' ' A' ' 23' ' ' SER . 0.5 OUTLIER -100.19 159.77 3.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.892 -179.961 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.502 ' N ' ' CG2' ' A' ' 22' ' ' VAL . 2.0 t -131.04 117.11 16.98 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.04 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.449 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 71.8 Cg_endo -77.12 147.48 85.89 Favored 'Cis proline' 0 C--N 1.349 0.581 0 C-N-CA 123.36 -1.517 . . . . 0.0 112.188 0.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.22 136.51 9.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.727 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -128.07 166.89 17.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.222 0.534 . . . . 0.0 111.673 -179.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.865 HD21 HG12 ' A' ' 16' ' ' ILE . 5.0 tt -121.27 132.97 55.12 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.852 179.411 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 49.8 m -119.68 126.95 52.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.155 0.502 . . . . 0.0 112.031 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.482 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 57.9 t90 -100.58 130.31 46.62 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.884 179.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 24.4 tpt85 -125.25 114.99 19.67 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.837 0.351 . . . . 0.0 110.725 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.465 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 72.5 p -45.47 165.37 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.06 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.59 -42.35 58.87 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.481 0.658 . . . . 0.0 109.795 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -78.55 -22.74 46.78 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.101 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.52 33.44 10.27 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.381 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -111.36 -18.67 12.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.56 0.219 . . . . 0.0 111.588 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.506 ' NZ ' HG21 ' A' ' 12' ' ' VAL . 6.3 mtmt -128.65 134.57 48.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.909 0.385 . . . . 0.0 111.187 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 11.0 p -139.26 141.83 34.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.038 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.504 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 71.0 t60 -137.6 146.1 43.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.125 0.488 . . . . 0.0 111.286 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 37.2 m -127.74 135.11 49.7 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.97 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.6 t -130.72 140.86 47.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 121.008 0.432 . . . . 0.0 111.548 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.772 HG13 ' CG2' ' A' ' 44' ' ' THR . 1.3 p -86.37 118.11 32.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.178 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 1.013 HD13 HD13 ' A' ' 107' ' ' ILE . 63.9 mt -70.89 -31.2 67.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.239 -0.437 . . . . 0.0 112.159 -178.34 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.439 ' CB ' ' HB2' ' A' ' 24' ' ' PRO . 2.0 t -52.67 -23.79 7.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.759 0.314 . . . . 0.0 111.543 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.772 ' CG2' HG13 ' A' ' 41' ' ' VAL . 0.2 OUTLIER -86.25 -25.94 25.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.092 -179.866 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.527 HG12 ' HA ' ' A' ' 42' ' ' LEU . 41.6 mm -49.62 98.8 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.045 0.45 . . . . 0.0 111.116 -179.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -94.22 -21.01 19.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.583 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.408 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 61.2 mttm -156.61 137.68 13.61 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.976 0.417 . . . . 0.0 111.362 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.707 HD11 ' HB3' ' A' ' 104' ' ' LEU . 60.0 mt -109.37 124.26 50.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.595 179.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.448 ' HG3' ' CD1' ' B' ' 54' ' ' PHE . 4.8 tp60 -109.66 130.93 55.47 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.55 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.527 ' HB3' ' NZ ' ' A' ' 101' ' ' LYS . . . -141.87 140.79 32.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.192 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.465 HG23 ' O ' ' A' ' 59' ' ' MET . 71.3 p -75.7 124.0 88.59 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.523 179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -61.51 160.31 28.43 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.578 2.185 . . . . 0.0 112.598 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.58 -42.97 97.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.095 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 86.2 p -60.26 -27.66 67.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.041 0.448 . . . . 0.0 110.603 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 28.7 t -81.22 119.9 24.2 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.806 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.1 tp10 -55.88 -18.86 9.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.386 179.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.1 mmtt -60.42 151.62 27.65 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.895 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.462 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 45.6 mtp -143.14 89.46 2.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.606 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.465 ' O ' HG23 ' A' ' 51' ' ' THR . 3.0 tmm? -172.85 147.22 1.67 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.001 0.429 . . . . 0.0 111.469 -179.558 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.741 HD11 ' HB2' ' A' ' 101' ' ' LYS . 0.4 OUTLIER -114.39 134.53 54.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.309 179.687 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.446 ' HB2' ' CZ ' ' B' ' 54' ' ' PHE . 0.5 OUTLIER -120.82 124.22 44.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.036 0.446 . . . . 0.0 111.742 -179.519 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.5 HD11 HD23 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -94.89 144.14 25.9 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.433 179.386 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.558 HD13 ' HG2' ' A' ' 86' ' ' ARG . 1.2 mm -118.27 124.01 72.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.019 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -92.17 154.53 22.42 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.534 -0.841 . . . . 0.0 112.367 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 37.3 mttt -67.75 155.56 39.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.837 0.351 . . . . 0.0 110.851 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.72 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.3 p -121.16 -162.31 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.996 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.72 ' H ' HG22 ' A' ' 66' ' ' VAL . 40.6 t0 -177.67 71.11 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.234 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.672 ' HB3' HG23 ' A' ' 81' ' ' VAL . 82.0 mt-10 -55.13 -23.38 20.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.341 -179.391 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.9 m -62.93 -15.04 53.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.935 179.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.3 mmtt -66.81 -43.86 82.75 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.709 0.29 . . . . 0.0 111.038 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.4 mptt 60.67 93.09 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.781 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.434 ' HD2' HG22 ' A' ' 80' ' ' VAL . 0.0 OUTLIER -104.47 137.91 41.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.87 -179.812 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.9 mmtp -83.7 145.33 28.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.088 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.472 ' CG ' HG11 ' A' ' 80' ' ' VAL . 9.0 m-20 -88.02 176.82 7.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.975 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -67.01 -15.99 64.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.404 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -88.38 -7.9 55.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.242 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 94.37 9.27 59.25 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.626 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -103.29 145.7 29.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.791 0.329 . . . . 0.0 110.864 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -78.4 140.87 38.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.963 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.472 HG11 ' CG ' ' A' ' 74' ' ' ASP . 1.3 m -140.56 152.63 21.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.191 0.52 . . . . 0.0 111.387 -179.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.672 HG23 ' HB3' ' A' ' 68' ' ' GLU . 2.3 p -85.29 109.03 18.17 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.554 178.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.444 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 52.2 Cg_exo -53.22 145.55 43.4 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.128 1.885 . . . . 0.0 112.483 -178.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 2.9 mmpt? -89.97 154.52 47.52 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.997 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 19.2 Cg_exo -71.48 144.26 44.76 Favored 'Trans proline' 0 N--CA 1.465 -0.189 0 C-N-CA 123.514 2.81 . . . . 0.0 112.685 -178.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -66.43 141.93 57.76 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.97 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.558 ' HG2' HD13 ' A' ' 63' ' ' ILE . 16.9 mtm180 -144.78 120.0 10.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.651 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.422 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 68.3 m-70 -109.55 159.05 17.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.538 179.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.567 ' SD ' HG21 ' B' ' 50' ' ' ILE . 13.7 ttt -133.62 139.96 46.82 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.076 0.465 . . . . 0.0 111.401 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.639 ' CE2' HD11 ' A' ' 16' ' ' ILE . 91.7 m-85 -148.71 125.35 11.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.146 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 27.0 t -101.63 134.52 44.64 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.967 0.413 . . . . 0.0 111.542 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.823 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 2.2 m-85 -123.37 130.3 52.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.583 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.462 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 12.9 m120 -74.3 -18.57 60.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.353 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.527 ' HB2' HG23 ' A' ' 96' ' ' VAL . 96.8 m-20 -114.51 114.36 25.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.827 0.346 . . . . 0.0 110.825 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.94 -26.64 26.46 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.057 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.14 -46.04 62.34 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.255 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.527 HG23 ' HB2' ' A' ' 93' ' ' ASN . 61.4 t -58.49 -52.36 60.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.622 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.458 ' HB3' ' CG ' ' A' ' 91' ' ' PHE . 9.8 ptm -60.24 -32.35 71.06 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.418 ' O ' ' HE2' ' A' ' 102' ' ' MET . 47.3 t0 -61.55 -35.02 76.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.388 179.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.437 ' O ' ' HB ' ' A' ' 103' ' ' THR . 65.6 m-80 -71.66 -44.42 64.34 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.459 179.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.581 HG22 HD12 ' A' ' 104' ' ' LEU . 23.2 mm -60.53 -52.1 65.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.14 0.495 . . . . 0.0 110.679 179.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.741 ' HB2' HD11 ' A' ' 60' ' ' LEU . 1.3 ttmt -62.2 -30.88 71.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.799 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.418 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 41.8 mtm -78.56 -40.45 34.76 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.855 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.437 ' HB ' ' O ' ' A' ' 99' ' ' ASN . 0.6 OUTLIER -76.06 -42.99 45.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.874 -179.879 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.757 ' CD2' HD22 ' A' ' 42' ' ' LEU . 18.0 mt -60.73 -37.07 80.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.772 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.748 ' HA ' HD12 ' A' ' 108' ' ' ILE . 1.1 mm-40 -63.43 -29.75 70.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.836 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -67.4 -37.1 82.57 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.972 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.013 HD13 HD13 ' A' ' 42' ' ' LEU . 3.5 mt -68.51 -44.08 83.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.294 -179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.914 HG22 ' CD ' ' A' ' 112' ' ' LYS . 2.5 mt -60.83 -61.21 1.66 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.589 0 CA-C-O 121.847 0.832 . . . . 0.0 109.393 179.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 27.5 m -53.27 -28.85 29.9 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.172 -1.376 . . . . 0.0 110.853 179.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 51.4 mtt-85 -72.45 -33.74 67.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.666 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.452 ' CE2' ' CG2' ' A' ' 107' ' ' ILE . 22.3 m-30 -87.99 -31.12 19.52 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.842 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.914 ' CD ' HG22 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -62.95 -35.37 79.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.045 0.45 . . . . 0.0 110.64 179.637 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -58.28 -37.09 74.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.939 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.25 -33.54 74.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.138 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.312 -0.852 . . . . 0.0 110.871 179.968 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 26.5 tp . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.849 0.357 . . . . 0.0 111.171 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.6 m -126.99 166.29 23.47 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.923 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_exo -51.31 -44.78 41.13 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.583 2.189 . . . . 0.0 112.325 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -58.9 -29.98 67.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.798 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -62.65 -41.2 98.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.719 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.567 HG21 ' SD ' ' A' ' 88' ' ' MET . 34.3 mm -67.09 -27.77 40.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.305 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.04 -32.04 73.55 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.787 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -28.55 68.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.815 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' TRP . . . . . . . . . . . . . 12.8 m0 -55.98 -40.91 73.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.014 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' PHE . . . . . 0.448 ' CD1' ' HG3' ' A' ' 49' ' ' GLN . 98.0 m-85 -84.92 -24.24 28.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.017 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -76.5 -43.35 39.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.929 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -62.92 136.06 57.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.034 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -136.39 76.11 50.43 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.809 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo . . . . . 0 C--O 1.249 1.067 0 C-N-CA 122.595 2.197 . . . . 0.0 112.32 179.887 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo . . . . . 0 N--CA 1.477 0.513 0 CA-C-O 120.853 0.272 . . . . 0.0 111.821 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.4 t 57.32 103.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.887 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 78.0 m80 63.59 32.68 13.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.244 0.545 . . . . 0.0 111.039 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.653 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 80.6 p 178.47 172.99 0.7 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.688 178.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.412 ' CA ' ' CG1' ' A' ' 96' ' ' VAL . . . 153.17 117.2 0.67 Allowed Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.028 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.589 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -39.82 117.85 0.8 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.897 0.379 . . . . 0.0 111.224 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.654 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -134.47 152.03 51.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.738 -179.114 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.6 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.2 mp -98.39 126.69 51.41 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.263 0 CA-C-O 121.138 0.494 . . . . 0.0 110.78 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.507 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 9.5 t80 -118.82 128.66 54.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.724 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.439 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 82.4 mt-10 59.02 36.79 24.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.595 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.439 ' HB2' ' O ' ' A' ' 10' ' ' GLU . 1.6 mtmt 72.13 2.43 4.31 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.31 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.466 ' O ' ' N ' ' A' ' 9' ' ' PHE . 30.0 t -102.37 146.68 10.03 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.71 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.6 ' HA ' HG13 ' A' ' 8' ' ' ILE . 88.0 p -85.96 146.71 26.56 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.595 -179.294 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.46 ' O ' ' N ' ' A' ' 7' ' ' ALA . . . -177.33 -179.1 47.47 Favored Glycine 0 N--CA 1.442 -0.907 0 CA-C-N 115.168 -0.924 . . . . 0.0 111.758 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.589 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.0 mm -104.48 137.57 32.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-O 120.951 0.405 . . . . 0.0 110.229 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.781 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.73 118.22 54.05 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 178.758 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.562 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -125.63 124.44 41.19 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.162 0.506 . . . . 0.0 111.484 -178.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.535 ' CG1' HD12 ' A' ' 27' ' ' LEU . 76.5 mt -98.72 139.24 21.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.04 -179.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -130.93 112.31 12.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.954 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -86.62 0.63 54.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.341 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -76.57 -17.79 59.02 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 121.029 0.442 . . . . 0.0 110.283 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -95.99 134.86 32.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.858 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.404 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 1.0 OUTLIER -111.37 116.68 50.59 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.016 -179.971 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.44 ' HG2' HG23 ' A' ' 41' ' ' VAL . 95.7 Cg_endo -78.21 154.05 92.9 Favored 'Cis proline' 0 C--N 1.349 0.554 0 C-N-CA 123.387 -1.505 . . . . 0.0 112.125 0.003 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.423 ' HB1' HD12 ' A' ' 42' ' ' LEU . . . -49.3 138.34 12.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.891 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -134.26 162.54 31.9 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.174 0.512 . . . . 0.0 111.517 -179.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.781 HD21 HG12 ' A' ' 16' ' ' ILE . 5.8 tt -121.25 125.39 46.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.536 179.244 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.2 m -113.24 126.95 55.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.156 0.503 . . . . 0.0 112.295 -178.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.47 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 64.2 t90 -100.41 128.97 46.33 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.914 178.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.673 ' HG3' HG22 ' A' ' 37' ' ' VAL . 15.9 ttm105 -128.31 117.94 22.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.824 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.444 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 17.0 t -44.73 155.88 0.09 Allowed 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.768 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.447 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -65.06 -39.62 93.53 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.529 0.681 . . . . 0.0 109.349 -179.925 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -79.99 -25.32 40.35 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 114.634 -1.166 . . . . 0.0 111.132 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 90.97 31.65 9.71 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.662 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -101.9 -21.2 14.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.61 0.243 . . . . 0.0 111.442 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 11.8 mtmt -128.69 138.33 52.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.764 0.316 . . . . 0.0 111.141 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.673 HG22 ' HG3' ' A' ' 30' ' ' ARG . 47.4 t -139.09 132.85 39.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.032 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.507 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 65.5 t60 -136.65 146.31 45.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.137 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 49.0 m -127.68 139.1 52.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.107 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 96.1 t -128.49 140.91 47.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.183 0.516 . . . . 0.0 111.674 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.629 HG13 HG23 ' A' ' 44' ' ' THR . 2.0 p -87.64 118.17 32.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.386 -0.825 . . . . 0.0 109.22 178.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 1.097 HD13 HD13 ' A' ' 107' ' ' ILE . 89.2 mt -73.5 -30.72 63.31 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -178.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.409 ' HB2' ' HB2' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -53.14 -24.3 10.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.819 0.342 . . . . 0.0 111.69 -179.486 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.629 HG23 HG13 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -92.58 -24.67 18.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.103 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.768 HD12 ' HB3' ' A' ' 62' ' ' LEU . 39.2 mm -61.25 85.44 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.712 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -70.81 -29.04 65.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.543 -179.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.66 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 10.0 mmmt -139.35 146.44 40.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.024 0.44 . . . . 0.0 111.789 -179.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.645 HD23 ' HG2' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -126.74 126.36 43.34 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.741 179.138 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -119.87 149.45 42.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.971 0.415 . . . . 0.0 111.236 -179.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.701 ' HB3' ' NZ ' ' A' ' 101' ' ' LYS . . . -148.08 146.76 28.97 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.953 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 54.6 p -75.87 122.73 87.57 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.332 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -61.42 160.32 27.99 Favored 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 122.597 2.198 . . . . 0.0 112.578 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.453 ' HB2' ' NH2' ' A' ' 94' ' ' ARG . . . -59.68 -42.75 93.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.103 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 86.3 p -57.92 -26.94 62.87 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.044 0.45 . . . . 0.0 110.783 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.7 t -85.69 118.57 25.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.845 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -56.69 -18.5 12.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.542 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.428 ' HD2' ' CE3' ' B' ' 53' ' ' TRP . 69.3 mmtt -63.54 147.1 52.31 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.954 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.44 ' HE3' ' HB3' ' A' ' 58' ' ' MET . 19.6 mmm -133.74 85.0 2.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.592 -179.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.448 ' CE ' ' CE3' ' B' ' 53' ' ' TRP . 31.7 mtm -154.67 165.87 35.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.229 0.538 . . . . 0.0 112.002 -179.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.445 HD12 ' HB2' ' A' ' 50' ' ' ALA . 2.8 tp -133.79 126.81 31.4 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.997 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.1 ttt180 -117.1 127.18 53.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.928 0.394 . . . . 0.0 111.882 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.768 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -106.42 144.1 33.59 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.269 179.482 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.66 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 2.0 mm -111.27 126.04 68.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.818 0.342 . . . . 0.0 111.211 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -91.25 131.91 11.01 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.2 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -44.3 137.84 3.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.847 0.356 . . . . 0.0 111.245 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.757 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.4 p -93.85 -162.39 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.052 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.757 ' H ' HG22 ' A' ' 66' ' ' VAL . 52.1 t0 -167.38 73.28 0.12 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.088 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 85.6 mt-10 -55.11 -21.97 14.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.439 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 37.1 m -57.06 -19.01 16.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.174 179.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.78 -54.57 43.56 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.986 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.5 mmtt 60.92 93.64 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.838 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 10.8 mtt180 -111.22 143.83 41.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.835 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.1 mttp -98.48 145.21 27.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.168 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -87.65 175.25 7.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.899 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -64.31 -19.52 65.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.39 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 51.8 mp0 -86.95 6.39 32.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.59 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.47 14.59 82.33 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.766 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -104.65 148.96 25.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.767 0.317 . . . . 0.0 110.548 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -82.62 142.82 31.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.874 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.458 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.3 m -134.3 158.87 42.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.224 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 30.7 t -101.38 98.81 9.78 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.724 178.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.458 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 95.3 Cg_exo -42.99 145.4 1.17 Allowed 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.491 2.127 . . . . 0.0 112.681 -178.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.486 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 15.4 mttt -82.67 147.8 56.38 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.057 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 13.8 Cg_exo -74.18 160.69 42.09 Favored 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 123.394 2.729 . . . . 0.0 112.713 -179.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.53 151.31 46.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.668 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.81 120.99 7.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.096 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -99.48 158.47 15.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.419 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.2 ttt -133.62 132.46 40.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.026 0.441 . . . . 0.0 111.477 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.583 ' CD2' HD11 ' A' ' 16' ' ' ILE . 96.6 m-85 -138.93 146.25 40.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.367 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.426 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 6.1 t -121.96 133.76 54.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.948 0.404 . . . . 0.0 111.282 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.654 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 3.3 m-85 -123.47 171.26 9.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.718 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -130.89 20.49 4.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.171 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.442 ' ND2' HG23 ' A' ' 96' ' ' VAL . 45.1 t-20 -152.1 113.98 4.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.812 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.453 ' NH2' ' HB2' ' A' ' 53' ' ' ALA . 17.6 mmm180 -55.62 -31.74 62.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.914 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.03 -55.05 14.03 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.043 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.442 HG23 ' ND2' ' A' ' 93' ' ' ASN . 57.6 t -59.06 -47.68 89.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.338 179.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.436 ' HG3' ' CD1' ' A' ' 91' ' ' PHE . 16.4 ttp -64.46 -29.45 70.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.96 179.091 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -65.6 -34.08 77.41 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.403 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.428 ' O ' ' HB ' ' A' ' 103' ' ' THR . 60.2 m-80 -69.15 -40.44 78.2 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.591 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.571 HD12 ' CG2' ' A' ' 16' ' ' ILE . 24.3 mm -65.56 -52.12 54.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.739 179.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.701 ' NZ ' ' HB3' ' A' ' 50' ' ' ALA . 1.0 OUTLIER -63.07 -28.28 69.98 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.85 179.794 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 40.7 mtm -78.78 -40.81 32.13 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.66 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.428 ' HB ' ' O ' ' A' ' 99' ' ' ASN . 0.6 OUTLIER -75.52 -36.71 60.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.896 -179.97 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.715 ' HA ' HD12 ' A' ' 107' ' ' ILE . 13.5 mt -62.24 -40.37 95.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.876 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.798 ' HA ' HD12 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -62.32 -27.66 69.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.949 179.77 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -69.39 -40.36 77.44 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.996 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.097 HD13 HD13 ' A' ' 42' ' ' LEU . 4.0 mt -65.58 -44.99 93.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.296 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.798 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.1 mt -59.7 -61.0 1.66 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.608 0 CA-C-O 121.692 0.758 . . . . 0.0 109.259 179.057 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.5 t -50.97 -28.96 10.99 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.301 -1.318 . . . . 0.0 110.906 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 53.5 mtt-85 -68.48 -33.75 74.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.06 0.457 . . . . 0.0 110.576 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -105.44 -1.2 25.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.892 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.401 ' N ' ' O ' ' A' ' 108' ' ' ILE . 0.7 OUTLIER -108.19 -32.86 7.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.821 -179.847 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 87.1 m-20 -63.34 -35.46 80.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.737 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.02 -33.79 75.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.135 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 48.0 t0 . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.912 -179.995 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 58.3 mt . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.81 0.338 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.3 m -128.11 163.64 42.51 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.944 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -57.67 -38.48 93.15 Favored 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 122.686 2.257 . . . . 0.0 112.275 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -51.58 -23.61 4.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.84 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -65.86 -44.71 84.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.684 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.434 ' HA ' ' CD1' ' B' ' 53' ' ' TRP . 33.4 mm -69.92 -22.82 24.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.338 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -62.69 -32.43 73.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.928 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.88 -30.26 67.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.189 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' TRP . . . . . 0.448 ' CE3' ' CE ' ' A' ' 59' ' ' MET . 24.2 m95 -54.59 -27.1 36.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.762 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -110.25 -18.94 13.17 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.151 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -85.64 -42.6 14.17 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.745 0.307 . . . . 0.0 110.78 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -60.0 141.86 54.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.858 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -127.3 76.02 76.75 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.909 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo . . . . . 0 C--O 1.249 1.036 0 C-N-CA 122.645 2.23 . . . . 0.0 112.262 -179.949 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo . . . . . 0 N--CA 1.476 0.476 0 CA-C-O 120.814 0.256 . . . . 0.0 111.834 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.6 p -88.36 126.8 35.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.899 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.459 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 50.5 m80 65.74 35.76 6.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.094 0.473 . . . . 0.0 111.373 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.49 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 68.5 p -178.35 152.05 0.65 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.908 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.404 ' CA ' ' CG1' ' A' ' 96' ' ' VAL . . . 176.17 116.53 0.46 Allowed Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.139 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.633 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -46.77 104.35 0.05 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.146 0.498 . . . . 0.0 111.386 -179.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.682 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -119.26 152.4 36.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.753 -178.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.645 HG23 ' O ' ' A' ' 12' ' ' VAL . 0.9 OUTLIER -100.63 125.76 54.4 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.267 0 CA-C-O 121.09 0.471 . . . . 0.0 110.469 179.0 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.506 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 4.3 t80 -113.3 130.78 56.17 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.125 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 81.8 mt-10 55.88 35.0 24.63 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.046 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 42.9 mtpt 75.78 1.49 3.55 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.362 -179.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.645 ' O ' HG23 ' A' ' 8' ' ' ILE . 41.0 t -99.8 155.46 4.14 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.616 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.554 ' HA ' HG13 ' A' ' 8' ' ' ILE . 71.9 p -98.44 148.58 23.57 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.572 0.701 . . . . 0.0 112.643 -178.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.482 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.86 -179.58 46.91 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 114.595 -1.184 . . . . 0.0 110.344 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.633 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.69 142.15 20.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 117.613 0.707 . . . . 0.0 110.465 179.344 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.855 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.68 118.45 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.766 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.561 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.426 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -119.3 137.79 53.45 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.234 -178.565 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.721 HD12 ' CG2' ' A' ' 103' ' ' THR . 64.8 mt -110.66 140.11 31.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.094 -179.101 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 -132.27 111.63 11.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.08 -179.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -91.14 3.44 54.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.2 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -78.81 -17.23 56.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.883 0.373 . . . . 0.0 110.469 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.87 141.66 16.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.941 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.469 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.3 t -114.37 116.58 43.94 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.747 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.469 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 1.6 Cg_endo -81.33 142.62 56.22 Favored 'Cis proline' 0 C--N 1.347 0.489 0 C-N-CA 123.818 -1.326 . . . . 0.0 111.904 -0.068 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.06 141.59 3.17 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.054 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -135.77 167.12 21.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.102 0.477 . . . . 0.0 111.739 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.855 HD21 HG12 ' A' ' 16' ' ' ILE . 4.5 tt -121.26 129.84 53.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.582 179.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.7 m -117.34 126.82 53.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.225 0.536 . . . . 0.0 112.156 -178.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.485 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 58.8 t90 -100.62 128.3 46.72 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.895 178.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.6 tpt180 -124.98 116.94 22.95 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.783 0.325 . . . . 0.0 111.065 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.482 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 12.5 m -45.49 166.23 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.01 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.75 -41.63 64.93 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.517 0.675 . . . . 0.0 109.526 179.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -84.66 -20.0 31.99 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.006 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.39 33.6 11.49 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.41 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -100.7 -22.85 14.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.658 0.266 . . . . 0.0 111.446 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 4.5 mtmt -130.23 137.56 50.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.777 0.322 . . . . 0.0 111.025 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 14.6 p -139.16 132.31 38.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.059 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.506 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 62.1 t60 -131.38 145.94 52.05 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.045 0.45 . . . . 0.0 111.222 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 48.5 m -129.12 134.48 48.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.025 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.9 t -126.71 140.81 47.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.031 0.443 . . . . 0.0 111.447 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.633 HG22 HG23 ' A' ' 44' ' ' THR . 1.9 p -85.54 117.55 30.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 1.018 HD13 HD13 ' A' ' 107' ' ' ILE . 83.6 mt -75.39 -31.69 60.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.244 -0.434 . . . . 0.0 112.097 -178.552 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.446 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 10.9 t -53.95 -23.36 12.76 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -179.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.633 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -92.07 -21.24 20.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.716 0.293 . . . . 0.0 111.014 -179.736 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.86 HD12 ' HB3' ' A' ' 62' ' ' LEU . 36.4 mm -57.75 87.03 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.995 0.426 . . . . 0.0 111.067 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.416 ' N ' ' O ' ' A' ' 63' ' ' ILE . 21.8 t70 -64.77 -32.57 74.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.0 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.703 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 4.4 mmmt -142.67 149.7 39.22 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.055 0.455 . . . . 0.0 111.28 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.595 HD21 ' HG3' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -131.98 125.95 32.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.778 179.175 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -136.79 158.91 43.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.994 0.426 . . . . 0.0 111.431 -179.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 1.086 ' HB2' HD12 ' A' ' 60' ' ' LEU . . . -148.12 166.49 27.7 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.958 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.58 HG22 ' CD2' ' B' ' 54' ' ' PHE . 81.4 p -75.65 148.33 82.49 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.823 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.82 149.59 86.56 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.587 2.191 . . . . 0.0 112.362 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.82 -36.38 83.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.176 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.6 t -59.96 -26.29 65.88 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.994 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 24.1 t -86.62 117.09 25.16 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.918 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -56.98 -18.62 14.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.539 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.447 ' HD2' ' CE3' ' B' ' 53' ' ' TRP . 9.4 mttp -83.95 127.88 34.16 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.945 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.416 ' HB3' ' O ' ' A' ' 91' ' ' PHE . 2.0 ttm -102.02 149.88 23.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.935 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.451 ' HB3' HG23 ' A' ' 51' ' ' THR . 0.0 OUTLIER 178.38 138.91 0.09 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.914 0.388 . . . . 0.0 111.269 179.652 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 1.086 HD12 ' HB2' ' A' ' 50' ' ' ALA . 7.6 tp -126.1 123.92 39.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.122 179.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 20.8 mmt85 -110.14 123.56 49.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.929 0.395 . . . . 0.0 111.72 -179.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.86 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -109.25 128.07 54.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.372 179.466 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.703 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -105.63 122.69 59.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.576 -0.283 . . . . 0.0 110.986 179.871 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.89 -129.27 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.464 -0.874 . . . . 0.0 111.843 179.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.3 mttp -130.13 155.08 46.79 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.629 0.252 . . . . 0.0 110.516 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.75 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.2 p -118.78 -164.01 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.928 0.395 . . . . 0.0 111.243 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.75 ' H ' HG22 ' A' ' 66' ' ' VAL . 21.1 t70 -178.94 75.66 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.186 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.496 ' HG3' HG23 ' A' ' 81' ' ' VAL . 55.7 mp0 -55.0 -22.49 15.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.446 -179.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 37.6 m -58.24 -18.34 25.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.127 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.2 -61.4 1.83 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.907 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp 62.96 94.4 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.94 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.6 mtt180 -97.15 141.49 30.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.984 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.419 ' HA ' ' HA ' ' A' ' 79' ' ' GLU . 55.8 mmtt -78.76 145.13 34.57 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.911 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.499 ' HB3' HG11 ' A' ' 80' ' ' VAL . 37.3 p30 -97.23 175.85 6.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.068 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -60.59 -19.68 58.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.333 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -87.08 7.48 27.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.512 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.78 13.7 80.4 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.738 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -111.01 145.42 38.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.825 0.345 . . . . 0.0 110.845 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.419 ' HA ' ' HA ' ' A' ' 73' ' ' LYS . 96.9 mt-10 -72.16 143.13 49.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.069 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.499 HG11 ' HB3' ' A' ' 74' ' ' ASP . 1.3 m -140.59 151.82 20.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.072 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.496 HG23 ' HG3' ' A' ' 68' ' ' GLU . 2.3 p -85.62 108.62 17.1 Favored Pre-proline 0 C--N 1.319 -0.745 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.62 178.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.462 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 46.0 Cg_exo -56.72 145.98 79.64 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.125 1.883 . . . . 0.0 112.257 -178.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.413 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 18.6 mtmt -83.12 148.12 55.62 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.034 0.445 . . . . 0.0 110.882 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 13.2 Cg_exo -74.28 158.71 44.64 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 C-N-CA 123.342 2.695 . . . . 0.0 112.695 -179.032 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.47 136.31 56.28 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.61 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 32.2 mtm105 -134.69 138.31 44.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.852 0.358 . . . . 0.0 111.214 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -118.15 157.03 27.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.358 179.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.809 ' SD ' HG21 ' B' ' 50' ' ' ILE . 8.5 ttt -133.58 120.48 20.79 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.95 0.405 . . . . 0.0 111.372 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.642 ' CE2' HD11 ' A' ' 16' ' ' ILE . 97.0 m-85 -126.24 133.05 51.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.574 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -106.09 133.63 50.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.885 0.374 . . . . 0.0 111.147 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.682 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 2.5 m-85 -122.74 170.45 10.05 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.575 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -121.57 -22.83 5.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.801 0.334 . . . . 0.0 111.304 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -108.1 100.2 9.56 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.38 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -47.8 -30.16 3.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.111 0.481 . . . . 0.0 111.111 -179.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.45 -47.58 54.82 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.227 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.404 ' CG1' ' CA ' ' A' ' 5' ' ' GLY . 57.5 t -61.31 -50.22 81.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.395 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.829 ' HE3' ' HB1' ' A' ' 50' ' ' ALA . 41.8 ttp -62.49 -29.61 70.67 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -60.31 -34.49 73.86 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 121.098 0.475 . . . . 0.0 109.953 179.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -71.56 -33.68 69.31 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.891 178.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.508 HG21 HD22 ' A' ' 60' ' ' LEU . 19.6 mm -61.8 -47.83 91.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.586 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.651 ' HD3' ' HB3' ' A' ' 50' ' ' ALA . 13.4 mttt -67.47 -27.97 67.47 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.21 0.528 . . . . 0.0 110.357 179.354 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 77.5 mtp -78.55 -39.41 37.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.505 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.721 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -76.43 -40.54 50.39 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.714 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.743 ' HA ' HD12 ' A' ' 107' ' ' ILE . 18.9 mt -63.78 -36.83 85.19 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.85 0.357 . . . . 0.0 110.516 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.757 ' HA ' HD12 ' A' ' 108' ' ' ILE . 20.7 mt-30 -63.3 -29.37 70.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.973 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -68.98 -31.5 70.39 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.141 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.018 HD13 HD13 ' A' ' 42' ' ' LEU . 4.2 mt -76.49 -46.15 32.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.479 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.945 HG22 ' CD ' ' A' ' 112' ' ' LYS . 2.2 mt -57.1 -61.38 1.28 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.568 0 CA-C-O 121.746 0.784 . . . . 0.0 109.544 179.326 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 18.2 t -50.27 -28.84 8.4 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.396 -1.275 . . . . 0.0 110.462 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.36 -35.01 79.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.671 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -89.55 -31.28 17.69 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.869 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.945 ' CD ' HG22 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -65.36 -41.17 94.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.956 0.408 . . . . 0.0 110.603 179.625 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -59.78 -37.35 78.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.926 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.94 -32.77 74.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.094 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.915 -179.99 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 40.0 mt . . . . . 0 N--CA 1.488 1.436 0 CA-C-O 120.879 0.371 . . . . 0.0 111.133 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.7 m -122.46 160.75 46.94 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.872 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_exo -52.25 -40.75 69.06 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.586 2.191 . . . . 0.0 112.347 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -56.65 -27.32 58.28 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.038 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -64.34 -43.12 95.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.852 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.809 HG21 ' SD ' ' A' ' 88' ' ' MET . 37.9 mm -69.9 -27.15 31.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.195 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.72 -33.22 75.45 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.876 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.68 -28.91 69.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.052 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' TRP . . . . . 0.447 ' CE3' ' HD2' ' A' ' 57' ' ' LYS . 11.9 m0 -55.21 -31.18 61.24 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.898 0.38 . . . . 0.0 110.913 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' PHE . . . . . 0.58 ' CD2' HG22 ' A' ' 51' ' ' THR . 71.5 m-85 -77.1 -34.97 56.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.02 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -82.21 -51.92 7.46 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.86 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -80.12 143.11 34.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.926 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -130.49 160.88 63.89 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.884 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo . . . . . 0 C--O 1.25 1.117 0 C-N-CA 122.594 2.196 . . . . 0.0 112.307 -179.978 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo . . . . . 0 N--CA 1.476 0.479 0 CA-C-O 120.808 0.253 . . . . 0.0 111.827 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.9 t 58.06 99.76 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.019 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 79.4 m80 64.16 33.44 11.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.234 0.54 . . . . 0.0 110.981 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.615 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 53.0 p 179.33 174.62 0.75 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.62 179.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.409 ' HA3' HG13 ' A' ' 96' ' ' VAL . . . 153.53 120.03 0.77 Allowed Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.466 -0.874 . . . . 0.0 112.522 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.628 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -47.21 105.76 0.07 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.151 0.501 . . . . 0.0 111.34 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.759 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -120.49 151.52 39.25 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.761 -178.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.567 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -99.67 124.26 52.94 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.256 0 CA-C-O 121.014 0.435 . . . . 0.0 110.29 179.046 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.495 ' CZ ' ' CD2' ' A' ' 38' ' ' HIS . 16.9 t80 -112.7 130.38 56.08 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.112 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.42 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 83.4 mt-10 56.4 34.21 23.79 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.037 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.0 mttm 76.24 1.35 3.39 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.249 -179.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.529 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.6 t -99.71 154.42 4.26 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.671 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 178.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.567 ' HA ' HG13 ' A' ' 8' ' ' ILE . 78.0 p -97.31 148.47 23.1 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-O 121.604 0.716 . . . . 0.0 112.546 -178.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.462 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.59 -179.72 46.61 Favored Glycine 0 N--CA 1.447 -0.627 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.397 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.628 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.66 142.2 20.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 117.74 0.77 . . . . 0.0 110.521 179.369 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.706 HD11 ' CE2' ' A' ' 89' ' ' PHE . 0.1 OUTLIER -106.69 118.56 54.64 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.758 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 179.557 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.499 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -121.3 134.46 55.15 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.315 -178.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.533 HD12 ' CG2' ' A' ' 103' ' ' THR . 96.7 mt -111.04 140.09 31.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.194 -179.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -128.72 112.65 14.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.004 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -87.36 6.16 34.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.267 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -78.34 -18.31 55.34 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.912 0.387 . . . . 0.0 110.411 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -100.39 146.76 8.57 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.859 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.401 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.5 t -121.51 115.5 31.07 Favored Pre-proline 0 CA--C 1.532 0.269 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.957 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.433 ' HB3' ' CB ' ' A' ' 43' ' ' SER . 5.6 Cg_exo -77.67 145.28 79.06 Favored 'Cis proline' 0 C--N 1.348 0.501 0 C-N-CA 123.633 -1.403 . . . . 0.0 111.842 -0.078 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.678 ' O ' HD22 ' A' ' 42' ' ' LEU . . . -44.15 140.81 1.98 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.818 0.342 . . . . 0.0 110.916 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -124.69 157.72 34.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.132 0.491 . . . . 0.0 111.716 -179.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.694 ' HB2' HD11 ' A' ' 42' ' ' LEU . 4.4 tt -121.28 128.9 52.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.494 179.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.9 m -119.63 125.79 49.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.143 0.496 . . . . 0.0 112.168 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.489 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 60.2 t90 -100.49 127.79 46.74 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.727 178.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 44.8 ttp85 -122.0 117.15 25.68 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.798 0.333 . . . . 0.0 111.013 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.462 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 64.0 m -46.66 162.93 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.913 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.83 -41.57 68.0 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.536 0.684 . . . . 0.0 109.551 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -82.14 -21.14 36.78 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.803 -1.09 . . . . 0.0 111.044 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.09 34.48 12.64 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.329 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 51.9 t0 -104.0 -19.4 14.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.615 0.245 . . . . 0.0 111.614 -179.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.57 142.17 45.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.888 0.375 . . . . 0.0 111.327 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 48.6 t -139.26 138.05 40.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.925 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.495 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 50.9 t60 -134.55 145.77 49.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.207 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.449 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 43.5 m -129.31 134.86 48.12 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.175 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 90.8 t -135.04 139.69 46.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 CA-C-O 121.127 0.489 . . . . 0.0 111.836 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.565 HG22 HG23 ' A' ' 44' ' ' THR . 1.6 p -88.63 117.46 32.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.505 177.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.766 ' H ' HD22 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -73.95 -28.28 61.43 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -179.035 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.433 ' CB ' ' HB3' ' A' ' 24' ' ' PRO . 11.9 t -55.96 -21.59 21.77 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.157 0.429 . . . . 0.0 112.157 -179.161 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.565 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -96.54 -21.9 17.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.833 0.349 . . . . 0.0 111.413 -179.446 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.918 HD12 ' HB3' ' A' ' 62' ' ' LEU . 47.6 mm -53.18 94.19 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.028 0.442 . . . . 0.0 111.053 -179.751 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -61.15 -28.87 69.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.393 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.615 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 16.3 mttm -153.41 162.92 40.78 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.167 0.508 . . . . 0.0 111.603 -179.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.796 HD11 ' HB3' ' A' ' 104' ' ' LEU . 22.2 mt -123.88 124.36 42.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.362 179.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.441 ' NE2' ' CG ' ' B' ' 54' ' ' PHE . 63.5 tt0 -111.07 130.34 55.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.621 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.585 ' HB3' ' NZ ' ' A' ' 101' ' ' LYS . . . -145.81 138.84 25.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.218 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.547 HG21 ' HB3' ' A' ' 57' ' ' LYS . 57.2 p -75.75 122.05 86.29 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.496 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -62.6 160.54 31.83 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.563 2.175 . . . . 0.0 112.49 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.92 -43.14 91.06 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.131 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.2 m -60.85 -27.71 68.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.06 0.457 . . . . 0.0 110.63 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 26.3 t -79.48 122.03 25.93 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.97 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -56.61 -18.74 13.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.284 179.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.547 ' HB3' HG21 ' A' ' 51' ' ' THR . 12.1 mptt -65.46 151.83 45.4 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.72 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.514 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 48.5 mtp -143.0 79.82 1.66 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.98 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.475 ' HG2' ' HE1' ' A' ' 88' ' ' MET . 0.9 OUTLIER -155.71 169.02 25.32 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.016 0.436 . . . . 0.0 111.569 -179.783 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.682 HD23 HD11 ' A' ' 62' ' ' LEU . 0.4 OUTLIER -135.85 126.82 27.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.147 179.554 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.442 ' HD3' ' CE1' ' B' ' 54' ' ' PHE . 32.8 mtp180 -119.06 129.9 55.34 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.93 0.395 . . . . 0.0 111.657 -179.342 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.918 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -106.1 141.81 36.85 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.397 179.613 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.615 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.1 mm -105.15 112.84 40.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.687 0.279 . . . . 0.0 111.326 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -83.82 125.36 7.03 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.605 -0.807 . . . . 0.0 112.36 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 50.6 mttt -49.46 153.6 1.07 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.826 0.346 . . . . 0.0 111.185 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.718 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.3 p -117.65 -161.9 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.061 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.718 ' H ' HG22 ' A' ' 66' ' ' VAL . 23.5 m-20 -167.37 62.21 0.08 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.496 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -49.58 -28.27 5.47 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.402 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 36.9 m -54.44 -18.83 4.66 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.118 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.7 mmtp -62.44 -37.3 85.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.858 0.361 . . . . 0.0 110.988 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.6 mptt 61.37 93.48 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.864 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 -104.72 157.3 17.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.861 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -111.27 145.5 38.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.896 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.405 ' HB3' HG11 ' A' ' 80' ' ' VAL . 35.7 p30 -93.07 174.45 7.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.987 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -62.14 -18.36 60.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.393 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -86.95 7.98 25.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.556 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.93 11.25 81.23 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.718 -0.754 . . . . 0.0 112.694 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -106.55 146.09 31.07 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.844 0.354 . . . . 0.0 110.709 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -73.77 148.83 42.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.971 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.477 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.4 m -136.11 159.05 38.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.982 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.9 t -100.54 98.74 8.54 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.701 178.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.477 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 79.8 Cg_exo -44.17 145.13 2.42 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.402 2.068 . . . . 0.0 112.789 -179.085 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.439 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 8.6 mtmt -95.11 151.05 38.53 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.879 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 18.0 Cg_exo -71.4 143.43 43.14 Favored 'Trans proline' 0 N--CA 1.465 -0.198 0 C-N-CA 123.48 2.786 . . . . 0.0 112.746 -178.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.1 mm-40 -65.37 151.47 46.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.02 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 90.5 mtt180 -148.79 119.78 7.68 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.565 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -98.71 150.88 21.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.759 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.475 ' HE1' ' HG2' ' A' ' 59' ' ' MET . 1.3 tmt? -128.47 122.23 30.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.13 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.706 ' CE2' HD11 ' A' ' 16' ' ' ILE . 93.2 m-85 -127.2 155.1 43.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.604 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 35.7 t -129.35 134.96 48.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.906 0.384 . . . . 0.0 110.953 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.759 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 3.0 m-85 -127.48 147.99 50.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.685 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.514 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 47.6 m-20 -95.33 -24.03 16.92 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.242 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.493 ' HB2' HG23 ' A' ' 96' ' ' VAL . 92.6 m-20 -106.59 115.53 30.35 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.806 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -57.29 -31.28 65.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.936 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.02 -45.06 90.58 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.233 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.493 HG23 ' HB2' ' A' ' 93' ' ' ASN . 57.4 t -58.24 -44.19 87.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.754 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.438 ' HG2' ' CG ' ' A' ' 91' ' ' PHE . 3.2 mtm -60.72 -32.24 71.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.316 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.517 ' O ' ' HE2' ' A' ' 102' ' ' MET . 48.8 t0 -64.06 -29.98 71.09 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.881 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -80.89 -50.17 10.1 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.02 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.527 HD12 ' CG2' ' A' ' 16' ' ' ILE . 23.5 mm -58.68 -52.26 62.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.005 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.585 ' NZ ' ' HB3' ' A' ' 50' ' ' ALA . 2.2 ttmt -61.16 -32.08 71.81 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.952 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.517 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 33.4 mtm -78.86 -40.36 32.76 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.166 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.533 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -72.16 -41.32 67.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.275 -179.552 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.796 ' HB3' HD11 ' A' ' 48' ' ' LEU . 12.5 mt -64.05 -38.42 91.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.789 0.328 . . . . 0.0 110.775 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.772 ' HA ' HD12 ' A' ' 108' ' ' ILE . 2.2 mt-30 -65.61 -28.81 69.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.764 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -68.52 -35.94 78.16 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.673 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.746 HD13 HD23 ' A' ' 42' ' ' LEU . 57.8 mt -68.35 -46.7 80.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.081 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.772 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.2 mt -59.02 -61.12 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.508 -0.637 0 CA-C-O 121.809 0.814 . . . . 0.0 109.218 179.099 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 8.5 t -50.53 -28.72 9.07 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.379 -1.282 . . . . 0.0 110.434 179.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.45 -48.94 68.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.412 0.625 . . . . 0.0 109.841 179.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.403 ' CE2' ' CB ' ' A' ' 43' ' ' SER . 39.4 m-85 -75.36 -28.99 59.77 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.291 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.48 ' HE2' HG22 ' A' ' 108' ' ' ILE . 11.4 mttm -63.83 -47.95 78.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.662 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 97.6 m-20 -62.78 -38.82 92.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.942 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.9 -34.94 79.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.127 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.16 -0.924 . . . . 0.0 110.899 179.959 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 49.7 mt . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.813 0.34 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 9.8 t -129.6 151.49 78.11 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.941 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -52.63 -30.27 44.84 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.479 2.119 . . . . 0.0 112.359 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -55.5 -22.95 23.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.115 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -81.61 -38.38 26.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.262 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 34.6 mm -78.39 -28.34 14.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.759 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -69.44 -30.64 68.61 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.917 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.09 -28.92 67.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.903 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' TRP . . . . . 0.42 ' CE3' ' HG3' ' A' ' 57' ' ' LYS . 10.2 m0 -54.1 -36.4 63.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.959 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' PHE . . . . . 0.442 ' CE1' ' HD3' ' A' ' 61' ' ' ARG . 91.2 m-85 -83.82 -26.96 29.12 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.992 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.38 -34.63 61.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.765 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 44.68 -166.17 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.408 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -122.05 160.94 45.21 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.862 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo . . . . . 0 C--O 1.249 1.042 0 C-N-CA 122.568 2.179 . . . . 0.0 112.325 179.964 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo . . . . . 0 N--CA 1.475 0.436 0 CA-C-O 120.882 0.284 . . . . 0.0 111.708 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.1 m -165.93 -76.93 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.892 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.419 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 54.8 m80 -113.05 34.0 4.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.164 0.507 . . . . 0.0 111.046 -179.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.493 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 36.5 p -170.48 145.42 2.61 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.547 179.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -177.69 116.91 0.56 Allowed Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.375 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.63 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -45.65 105.15 0.06 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.094 0.473 . . . . 0.0 111.437 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.761 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -120.59 151.42 39.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.905 -178.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.555 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -100.3 124.55 53.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.998 0.428 . . . . 0.0 110.425 179.145 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.501 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 11.1 t80 -112.79 130.58 56.03 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.179 179.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 56.14 34.24 23.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.007 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 25.8 mttp 76.38 1.06 3.32 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.334 -179.061 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.541 ' O ' HG23 ' A' ' 8' ' ' ILE . 41.7 t -99.35 154.93 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.633 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 178.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.555 ' HA ' HG13 ' A' ' 8' ' ' ILE . 98.1 p -98.05 148.72 23.23 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-O 121.67 0.748 . . . . 0.0 112.794 -178.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.453 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 175.52 -179.79 46.51 Favored Glycine 0 N--CA 1.446 -0.672 0 CA-C-N 114.452 -1.249 . . . . 0.0 110.285 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.63 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.61 143.13 17.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 117.688 0.744 . . . . 0.0 110.403 179.372 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.827 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.58 118.26 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 CA-C-N 115.335 -0.848 . . . . 0.0 108.767 179.575 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -121.52 124.58 44.75 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.2 0.524 . . . . 0.0 111.389 -178.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.736 HG23 HD11 ' A' ' 42' ' ' LEU . 53.6 mt -94.52 140.03 17.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.903 -179.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -127.37 111.53 13.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.079 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -95.81 5.39 51.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.239 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -79.71 -17.4 53.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.962 0.41 . . . . 0.0 110.538 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -102.96 145.39 12.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.938 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.404 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 4.4 t -119.67 116.41 33.24 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.86 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.413 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 73.0 Cg_endo -77.81 144.44 76.5 Favored 'Cis proline' 0 C--N 1.348 0.552 0 C-N-CA 123.491 -1.462 . . . . 0.0 112.332 0.09 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.411 ' HB1' HD12 ' A' ' 42' ' ' LEU . . . -50.7 151.4 2.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.88 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -137.62 165.75 25.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.201 0.524 . . . . 0.0 111.838 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.827 HD21 HG12 ' A' ' 16' ' ' ILE . 5.8 tt -121.24 121.98 38.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.325 179.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 41.0 m -112.56 124.93 53.64 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.482 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 56.3 t90 -100.65 127.74 46.95 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.875 178.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.17 118.33 27.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.852 0.358 . . . . 0.0 111.195 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.424 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 25.5 t -46.04 167.76 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.047 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.46 -42.43 59.07 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.481 0.658 . . . . 0.0 109.677 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 89.7 m-20 -89.11 -17.02 30.1 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.771 -1.104 . . . . 0.0 111.109 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.94 33.35 11.09 Favored Glycine 0 C--N 1.332 0.359 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.362 -179.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -95.46 -22.15 17.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.594 0.235 . . . . 0.0 111.492 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.6 143.08 37.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.826 0.346 . . . . 0.0 111.365 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 14.5 p -139.24 137.62 41.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.893 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.501 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 30.2 t60 -131.28 145.64 51.97 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.97 0.414 . . . . 0.0 111.218 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 40.9 m -129.09 136.03 49.69 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.959 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.694 ' CG1' HD11 ' A' ' 45' ' ' ILE . 77.5 t -130.07 141.73 45.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.235 0.54 . . . . 0.0 111.788 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.713 ' HB ' HG23 ' A' ' 44' ' ' THR . 0.0 OUTLIER -85.31 118.11 31.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.649 178.029 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 1.001 HD13 HD13 ' A' ' 107' ' ' ILE . 27.6 mt -66.89 -19.55 65.75 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.804 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.413 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 6.5 t -67.76 -25.43 65.62 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.799 179.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.713 HG23 ' HB ' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -87.1 -37.68 17.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.825 179.864 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.857 HG23 ' HB2' ' A' ' 62' ' ' LEU . 8.9 mm -58.31 87.99 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.492 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -83.96 -25.53 29.97 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.77 -178.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.559 ' HB2' HG12 ' A' ' 63' ' ' ILE . 13.6 mttp -125.17 158.0 35.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.21 0.529 . . . . 0.0 111.902 -179.098 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.854 HD12 ' HG3' ' A' ' 105' ' ' GLN . 28.8 mt -131.44 128.84 40.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.556 179.168 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.428 ' HG2' ' CD2' ' B' ' 54' ' ' PHE . 35.8 tt0 -129.54 130.38 45.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.885 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.458 ' HB2' ' CD1' ' A' ' 60' ' ' LEU . . . -143.51 137.66 28.65 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.019 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.469 ' O ' ' HE1' ' A' ' 97' ' ' MET . 31.6 p -75.67 126.24 87.53 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.8 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.43 160.74 46.44 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.509 2.139 . . . . 0.0 112.449 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.801 ' HB2' ' NH1' ' A' ' 94' ' ' ARG . . . -56.96 -42.95 81.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.11 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.0 m -61.5 -27.64 68.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.052 0.453 . . . . 0.0 110.697 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.3 m -77.48 121.68 24.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.879 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -56.22 -18.82 11.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.322 179.122 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.54 140.88 42.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.774 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 33.3 mtp -130.89 79.92 1.92 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.737 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.466 ' HE3' ' CE3' ' B' ' 53' ' ' TRP . 0.7 OUTLIER -150.83 168.75 23.49 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.135 0.493 . . . . 0.0 111.579 -179.683 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.458 ' CD1' ' HB2' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -137.84 123.78 20.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.973 179.474 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.419 ' O ' ' N ' ' A' ' 49' ' ' GLN . 40.4 ttt180 -127.93 136.78 51.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.795 0.331 . . . . 0.0 111.689 -179.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.857 ' HB2' HG23 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -119.41 144.09 47.12 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.443 179.227 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.688 ' N ' HD13 ' A' ' 63' ' ' ILE . 1.1 mm -101.08 134.23 41.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.827 0.346 . . . . 0.0 110.986 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -82.73 153.22 31.13 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.186 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.432 ' N ' ' O ' ' A' ' 44' ' ' THR . 38.4 mttt -60.12 163.13 5.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.709 0.29 . . . . 0.0 110.735 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.79 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.4 p -116.9 -163.43 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 121.018 0.437 . . . . 0.0 111.279 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.79 ' H ' HG22 ' A' ' 66' ' ' VAL . 56.0 m-20 -160.59 71.14 0.43 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.092 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.421 ' HG2' HG13 ' A' ' 81' ' ' VAL . 96.6 mt-10 -55.51 -20.9 14.36 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.534 -179.251 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 31.0 m -53.71 -21.69 7.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.797 0.332 . . . . 0.0 111.124 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.8 mtmm -76.32 -48.71 19.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.965 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 60.66 92.83 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.949 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 10.9 mtm180 -94.48 129.25 41.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.824 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 79' ' ' GLU . 29.1 mmtp -81.21 145.3 31.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.045 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -92.65 179.83 5.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.955 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -64.93 -18.84 65.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.333 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -87.82 -2.84 58.87 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.274 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.69 8.23 73.77 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.699 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 22.7 p30 -105.58 145.99 30.24 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.883 0.373 . . . . 0.0 110.93 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.421 ' HA ' ' HA ' ' A' ' 73' ' ' LYS . 49.5 mt-10 -71.83 143.78 49.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.92 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.444 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.8 m -138.86 158.77 30.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.165 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.421 HG13 ' HG2' ' A' ' 68' ' ' GLU . 37.4 t -83.88 110.22 24.01 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.444 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 88.3 Cg_exo -46.8 169.67 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.217 1.944 . . . . 0.0 112.758 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.498 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.1 OUTLIER -90.4 95.88 0.81 Allowed Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.215 -179.873 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.498 ' HD2' ' HA ' ' A' ' 83' ' ' LYS . 7.9 Cg_endo -46.53 161.45 0.18 Allowed 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 123.41 2.74 . . . . 0.0 112.363 179.289 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -65.48 159.92 23.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.655 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.641 ' HG2' HD12 ' A' ' 63' ' ' ILE . 6.2 mtp180 -155.23 133.15 11.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.24 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -118.52 133.3 55.98 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.314 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 22.7 ttt -113.95 137.29 51.88 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.986 0.422 . . . . 0.0 111.47 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.478 ' CE1' HD11 ' A' ' 16' ' ' ILE . 99.0 m-85 -139.27 151.22 46.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.486 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -123.27 135.24 54.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.893 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.761 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 2.8 m-85 -128.42 160.31 32.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.951 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 68.4 m-20 -110.64 9.96 22.89 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.277 179.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -141.64 107.75 5.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.636 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.801 ' NH1' ' HB2' ' A' ' 53' ' ' ALA . 1.9 tmm_? -49.02 -30.28 5.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.272 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.56 -55.11 6.73 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.451 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 56.4 t -55.39 -48.17 77.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.873 0.368 . . . . 0.0 110.707 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.469 ' HE1' ' O ' ' A' ' 51' ' ' THR . 15.4 ptm -63.82 -38.03 89.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.917 179.148 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -61.47 -34.36 75.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.365 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.431 ' O ' ' HB ' ' A' ' 103' ' ' THR . 81.6 m-20 -66.92 -41.45 87.06 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.631 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.594 HD12 ' CG2' ' A' ' 16' ' ' ILE . 27.2 mm -60.69 -52.37 62.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.853 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.633 ' O ' HD13 ' A' ' 48' ' ' LEU . 0.1 OUTLIER -67.16 -27.87 67.65 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.254 179.534 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 39.7 mtm -78.11 -36.89 47.43 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.72 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.448 HG22 HD13 ' A' ' 18' ' ' ILE . 0.5 OUTLIER -79.47 -39.85 31.21 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.497 179.815 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.704 ' CD2' HD22 ' A' ' 42' ' ' LEU . 28.1 mt -59.99 -35.69 75.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.764 179.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.854 ' HG3' HD12 ' A' ' 48' ' ' LEU . 1.9 mt-30 -61.39 -32.18 72.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.796 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -65.64 -28.17 68.91 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.076 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.001 HD13 HD13 ' A' ' 42' ' ' LEU . 3.1 mt -81.11 -44.14 20.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.634 -179.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.659 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.2 mt -58.19 -61.35 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.585 0 CA-C-O 121.603 0.716 . . . . 0.0 109.444 179.402 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.7 p -49.08 -31.14 7.37 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.48 -1.236 . . . . 0.0 110.366 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -61.78 -41.8 98.18 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.568 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -85.3 -29.07 24.85 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.428 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.425 ' HE2' HG22 ' A' ' 108' ' ' ILE . 11.6 mttm -62.11 -42.0 98.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.524 179.424 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -53.96 -37.14 63.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.061 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.02 -33.61 75.8 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.062 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 52.1 t0 . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.276 -0.868 . . . . 0.0 110.922 -179.961 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 60.6 mt . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.92 0.39 . . . . 0.0 111.219 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.3 m -128.98 163.81 43.15 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.793 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -53.94 -41.85 71.59 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.588 2.192 . . . . 0.0 112.289 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -55.79 -22.53 24.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.816 179.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -66.83 -49.43 65.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.759 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 41.4 mm -65.11 -24.72 35.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.175 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -63.69 -33.23 75.17 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.813 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -69.18 -31.04 69.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.966 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' TRP . . . . . 0.466 ' CE3' ' HE3' ' A' ' 59' ' ' MET . 15.0 m95 -54.99 -24.85 26.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.728 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' PHE . . . . . 0.449 ' CE2' ' CG2' ' A' ' 51' ' ' THR . 13.0 m-85 -115.39 -11.42 11.87 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.314 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -93.76 -29.75 15.21 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.712 0.291 . . . . 0.0 111.0 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -60.78 -37.71 82.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.949 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 10.4 t70 55.49 83.99 0.22 Allowed Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.147 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_exo . . . . . 0 C--O 1.25 1.093 0 C-N-CA 122.529 2.153 . . . . 0.0 112.431 179.936 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo . . . . . 0 N--CA 1.475 0.432 0 CA-C-O 120.745 0.227 . . . . 0.0 111.89 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 57.22 106.52 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.08 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 75.6 m80 63.93 31.9 13.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.195 0.521 . . . . 0.0 111.042 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.631 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 88.4 p 178.15 172.7 0.66 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.744 178.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.407 ' CA ' ' CG1' ' A' ' 96' ' ' VAL . . . 154.64 116.32 0.57 Allowed Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.746 -0.74 . . . . 0.0 111.966 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.583 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -40.39 117.56 0.82 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.846 0.355 . . . . 0.0 111.144 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.669 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -132.67 149.7 52.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.844 -178.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.596 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.1 mp -97.46 124.2 50.25 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 CA-C-O 121.023 0.44 . . . . 0.0 110.528 179.282 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.506 ' CD1' ' CE2' ' A' ' 89' ' ' PHE . 10.1 t80 -115.8 129.4 56.42 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.927 179.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 58.71 33.91 23.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.794 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.0 mttp 75.63 1.64 3.62 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.142 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.542 HG21 ' NZ ' ' A' ' 36' ' ' LYS . 32.7 t -100.94 151.42 5.34 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.694 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.596 ' HA ' HG13 ' A' ' 8' ' ' ILE . 85.3 p -90.36 145.89 24.6 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 121.435 0.636 . . . . 0.0 111.678 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.438 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -176.64 -179.22 46.96 Favored Glycine 0 N--CA 1.444 -0.817 0 CA-C-N 114.979 -1.009 . . . . 0.0 111.691 -179.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.583 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.9 mm -105.61 137.52 35.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 121.034 0.445 . . . . 0.0 110.194 179.667 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.753 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.1 OUTLIER -106.54 117.92 53.24 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.672 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.564 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -124.4 131.07 53.5 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.366 -177.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.766 HG23 HD11 ' A' ' 42' ' ' LEU . 89.0 mt -106.45 140.04 25.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.27 -179.261 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -132.25 112.49 12.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.971 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -90.95 6.14 45.85 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.215 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -79.44 -17.53 54.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.872 0.368 . . . . 0.0 110.529 179.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -100.2 143.27 14.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.972 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.445 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.9 t -115.15 116.26 42.36 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.821 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.445 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 1.8 Cg_endo -80.52 143.64 64.55 Favored 'Cis proline' 0 C--N 1.349 0.576 0 C-N-CA 123.701 -1.374 . . . . 0.0 111.928 -0.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.21 141.3 4.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.732 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 68.4 mt-10 -134.5 166.24 23.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.172 0.51 . . . . 0.0 111.877 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.677 HD21 HG12 ' A' ' 16' ' ' ILE . 5.5 tt -121.33 127.58 51.43 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.555 179.32 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 41.0 m -116.6 129.61 56.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.212 0.53 . . . . 0.0 112.13 -178.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.496 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 56.3 t90 -100.47 125.69 46.81 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.984 178.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -122.61 117.3 25.52 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.71 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.412 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 30.3 t -44.48 158.96 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.752 0.311 . . . . 0.0 110.88 -179.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.438 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -66.42 -39.48 88.97 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 121.616 0.722 . . . . 0.0 109.352 179.9 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 42.8 p30 -89.46 -18.93 25.78 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.296 179.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.04 32.0 11.3 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.672 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -99.29 -18.88 17.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.725 0.297 . . . . 0.0 111.467 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.542 ' NZ ' HG21 ' A' ' 12' ' ' VAL . 8.8 mtmt -134.97 140.6 45.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.089 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.2 t -139.11 137.09 42.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.897 0.38 . . . . 0.0 111.294 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.506 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 82.5 t60 -137.7 146.3 43.6 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.088 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 47.8 m -129.07 138.0 51.6 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.216 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.5 t -132.15 140.87 46.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 121.095 0.474 . . . . 0.0 111.421 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.574 HG22 HG23 ' A' ' 44' ' ' THR . 2.3 p -86.02 117.84 31.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.051 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 1.055 HD13 HD13 ' A' ' 107' ' ' ILE . 78.7 mt -75.47 -31.2 60.17 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.095 0.405 . . . . 0.0 112.095 -178.539 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.421 ' HB3' ' HB3' ' A' ' 24' ' ' PRO . 58.3 p -55.63 -21.86 19.81 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.122 0.415 . . . . 0.0 112.122 -178.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.574 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -96.28 -21.84 17.59 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.756 0.312 . . . . 0.0 111.271 -179.785 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.606 HD12 ' HB3' ' A' ' 62' ' ' LEU . 38.0 mm -50.19 95.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.059 0.457 . . . . 0.0 111.039 -179.755 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -67.68 -27.94 67.26 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.317 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.602 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 38.4 mttm -156.72 159.89 38.79 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.045 0.45 . . . . 0.0 111.569 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.578 HD23 ' HG3' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -131.73 128.16 38.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.777 179.357 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.787 ' O ' HD23 ' A' ' 60' ' ' LEU . 93.0 mt-30 -119.59 141.02 49.65 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.937 0.399 . . . . 0.0 111.071 -179.363 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.85 143.25 31.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.992 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.693 HG23 ' O ' ' A' ' 59' ' ' MET . 43.0 p -75.7 111.21 13.33 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.597 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -64.56 160.59 39.09 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.559 2.173 . . . . 0.0 112.621 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.21 -41.84 72.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.186 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.0 m -58.12 -27.54 63.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.115 0.484 . . . . 0.0 110.788 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 31.4 t -86.29 118.65 25.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.817 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -57.18 -18.36 15.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.476 179.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.403 ' HD2' ' CD2' ' B' ' 53' ' ' TRP . 71.4 mmtt -72.95 145.64 46.62 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.061 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 59.1 mtp -129.9 95.13 3.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.583 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.693 ' O ' HG23 ' A' ' 51' ' ' THR . 3.1 tmm? -175.36 148.65 0.96 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.053 0.454 . . . . 0.0 111.266 -179.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.787 HD23 ' O ' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -114.32 145.7 41.45 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.368 179.694 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.426 ' HB2' ' CZ ' ' B' ' 54' ' ' PHE . 16.1 mtt-85 -130.88 131.68 44.68 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.004 0.43 . . . . 0.0 111.726 -179.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.606 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -111.48 142.06 44.25 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.361 179.41 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.602 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.6 mm -103.51 150.17 7.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.746 0.308 . . . . 0.0 110.8 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -114.32 134.72 11.92 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.234 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 19.8 mttt -54.33 147.07 14.17 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.75 0.31 . . . . 0.0 110.877 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.739 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.2 p -115.0 -162.98 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.346 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.739 ' H ' HG22 ' A' ' 66' ' ' VAL . 52.1 t0 -178.69 76.58 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.102 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.467 ' OE2' HG11 ' A' ' 81' ' ' VAL . 48.1 mt-10 -53.71 -23.83 12.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.424 -179.393 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 42.3 m -61.93 -15.39 42.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.104 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.5 mmtp -64.02 -45.09 90.48 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.753 0.311 . . . . 0.0 111.067 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.9 mmtt 64.09 95.83 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.893 0.377 . . . . 0.0 110.79 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 26.1 mmt85 -106.54 146.99 29.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.849 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -104.04 145.16 30.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.966 0.413 . . . . 0.0 110.969 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 43.6 p30 -87.6 176.91 7.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.991 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -65.1 -16.97 64.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.357 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -86.43 6.66 29.22 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.518 -179.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.16 9.65 86.68 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.759 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.2 m-80 -101.31 161.15 13.83 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.763 0.316 . . . . 0.0 110.775 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -90.51 150.42 21.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.887 0.375 . . . . 0.0 110.927 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.469 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.7 m -140.5 158.72 24.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.167 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.467 HG11 ' OE2' ' A' ' 68' ' ' GLU . 20.4 t -86.72 108.89 20.16 Favored Pre-proline 0 C--N 1.326 -0.45 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 178.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.469 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 78.2 Cg_exo -50.23 145.29 20.94 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.111 1.874 . . . . 0.0 112.466 -178.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.466 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 7.4 mtpt -110.66 151.56 42.9 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.054 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 15.1 Cg_exo -73.41 155.03 50.98 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 C-N-CA 123.589 2.859 . . . . 0.0 112.642 -178.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -87.13 155.35 20.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.413 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 18.4 ttp180 -141.79 119.72 11.97 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.749 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 13.0 m-70 -94.64 136.33 35.06 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.221 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.69 ' SD ' HG21 ' B' ' 50' ' ' ILE . 0.3 OUTLIER -120.48 112.14 18.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.914 0.388 . . . . 0.0 111.541 -179.5 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.753 ' CD2' HD11 ' A' ' 16' ' ' ILE . 86.4 m-85 -118.12 125.19 49.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.156 179.16 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -95.06 128.8 42.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.968 0.413 . . . . 0.0 111.236 -179.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.669 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 75.2 m-85 -113.44 145.55 40.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.81 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -107.75 25.3 11.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.911 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.52 ' HB3' HG23 ' A' ' 96' ' ' VAL . 1.5 t30 -151.91 108.6 3.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.519 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 24.3 mtm-85 -52.0 -29.38 20.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.231 -179.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.12 -54.99 5.83 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.464 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.52 HG23 ' HB3' ' A' ' 93' ' ' ASN . 46.0 t -54.25 -47.14 68.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.813 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.5 ' HB2' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -61.39 -34.36 75.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.964 0.412 . . . . 0.0 110.21 179.337 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.427 ' O ' ' HB3' ' A' ' 102' ' ' MET . 50.6 t0 -63.63 -33.61 76.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.78 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 38.2 m-80 -67.45 -36.96 82.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.168 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.525 HD12 ' CG2' ' A' ' 16' ' ' ILE . 22.8 mm -66.31 -49.22 77.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.739 179.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.525 ' HB2' HD11 ' A' ' 48' ' ' LEU . 0.3 OUTLIER -65.27 -27.52 68.69 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.726 179.989 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.427 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -78.71 -40.91 32.36 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.165 179.654 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.437 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -74.23 -39.6 62.96 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.755 -179.898 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.71 ' HA ' HD12 ' A' ' 107' ' ' ILE . 13.2 mt -62.01 -41.03 97.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.714 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.77 ' HA ' HD12 ' A' ' 108' ' ' ILE . 6.1 mt-30 -62.95 -27.28 69.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.994 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -70.47 -32.01 69.37 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.96 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.055 HD13 HD13 ' A' ' 42' ' ' LEU . 5.8 mt -75.93 -46.19 35.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.504 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.77 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.0 mt -56.67 -61.34 1.25 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.585 0 CA-C-O 121.742 0.782 . . . . 0.0 109.635 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 11.5 t -51.0 -28.8 10.74 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.43 -1.259 . . . . 0.0 110.373 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.37 -40.13 95.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.344 179.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -84.14 -29.81 26.39 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.28 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.487 ' HE2' HG22 ' A' ' 108' ' ' ILE . 9.7 mttm -63.04 -43.59 98.24 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.496 179.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -58.48 -36.56 73.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.948 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.03 -32.87 74.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.107 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 . . . . . 0 C--O 1.248 0.993 0 CA-C-O 118.167 -0.921 . . . . 0.0 110.883 -179.975 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 7.9 mp . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.918 0.389 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -127.02 157.42 72.08 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.829 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_exo -52.02 -39.61 69.44 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.601 2.201 . . . . 0.0 112.342 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 93.3 m-20 -57.58 -26.72 61.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.846 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -77.58 -43.08 32.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.318 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.69 HG21 ' SD ' ' A' ' 88' ' ' MET . 33.0 mm -70.64 -31.98 47.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.801 -179.4 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -73.1 -28.5 62.32 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.03 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -66.5 -24.2 66.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.131 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 53' ' ' TRP . . . . . 0.403 ' CD2' ' HD2' ' A' ' 57' ' ' LYS . 17.6 m0 -51.86 -29.75 20.9 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.038 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 54' ' ' PHE . . . . . 0.426 ' CZ ' ' HB2' ' A' ' 61' ' ' ARG . 89.2 m-85 -95.8 -25.66 15.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.122 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -78.65 -29.72 45.94 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.866 0.365 . . . . 0.0 110.856 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -79.69 132.93 36.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.998 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -129.16 77.12 78.23 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.932 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo . . . . . 0 C--O 1.249 1.045 0 C-N-CA 122.485 2.123 . . . . 0.0 112.387 179.981 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo . . . . . 0 N--CA 1.476 0.46 0 CA-C-O 120.91 0.296 . . . . 0.0 111.943 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.5 p -76.37 -12.12 60.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.377 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.422 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 74.5 m80 -153.03 36.0 0.48 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.154 0.502 . . . . 0.0 110.917 -179.71 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.476 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 11.7 p -175.04 134.21 0.33 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.649 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -162.2 119.29 0.87 Allowed Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.417 179.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.648 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -43.86 106.12 0.06 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.204 0.526 . . . . 0.0 111.298 -179.612 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.741 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -120.15 152.08 38.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.916 -178.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.541 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -100.1 124.79 53.78 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.252 0 CA-C-O 120.959 0.409 . . . . 0.0 110.241 178.876 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.507 ' HB3' ' CZ3' ' A' ' 29' ' ' TRP . 27.3 t80 -112.25 130.43 55.93 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.19 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.427 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 88.9 mt-10 55.24 34.83 23.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.906 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.9 mtpt 76.1 1.3 3.43 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.353 -179.096 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.528 ' O ' HG23 ' A' ' 8' ' ' ILE . 41.4 t -99.38 154.98 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.643 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.541 ' HA ' HG13 ' A' ' 8' ' ' ILE . 90.4 p -96.65 148.96 22.33 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-O 121.562 0.696 . . . . 0.0 112.595 -178.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.447 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.31 -179.68 46.39 Favored Glycine 0 N--CA 1.445 -0.749 0 CA-C-N 114.569 -1.196 . . . . 0.0 110.181 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.648 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.9 143.19 18.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 117.632 0.716 . . . . 0.0 110.637 179.47 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.823 HG12 HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -106.76 118.63 54.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 179.571 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -119.03 129.13 54.95 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.168 0.508 . . . . 0.0 111.409 -178.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.48 HD12 ' CG2' ' A' ' 103' ' ' THR . 54.0 mt -102.9 140.07 22.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.934 -179.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 47.2 t-20 -132.48 111.42 11.26 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.913 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -93.23 4.64 53.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.247 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -78.95 -17.55 55.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.004 0.43 . . . . 0.0 110.437 179.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.64 140.75 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.92 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.443 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.5 t -112.94 116.93 46.93 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.767 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.443 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 1.1 Cg_endo -81.5 142.68 55.46 Favored 'Cis proline' 0 C--N 1.347 0.493 0 C-N-CA 123.878 -1.301 . . . . 0.0 112.054 0.082 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -48.58 142.85 5.53 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.88 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 72.9 mt-10 -136.03 167.19 21.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.126 0.489 . . . . 0.0 111.552 -179.58 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.823 HD21 HG12 ' A' ' 16' ' ' ILE . 5.3 tt -121.15 129.14 53.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.854 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.5 m -117.05 127.64 54.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.105 0.479 . . . . 0.0 112.011 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.507 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 57.0 t90 -100.57 130.05 46.58 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.111 179.151 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.5 ttt180 -124.97 116.29 21.93 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.938 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.447 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 10.6 m -45.45 163.85 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.042 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.88 -41.5 67.94 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 121.497 0.665 . . . . 0.0 109.551 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.2 t0 -83.3 -20.74 33.86 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.046 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.26 34.3 12.66 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.34 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -100.99 -21.24 15.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.572 0.225 . . . . 0.0 111.505 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.41 144.23 46.41 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.931 0.396 . . . . 0.0 111.329 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 11.7 p -139.4 137.76 40.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.011 179.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.498 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 13.6 t60 -132.31 145.53 51.34 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.859 0.361 . . . . 0.0 111.169 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 45.2 m -129.16 135.58 49.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.998 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.4 t -130.07 140.95 47.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.007 0.432 . . . . 0.0 111.642 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.51 ' CG1' HG23 ' A' ' 44' ' ' THR . 7.0 p -87.99 117.47 31.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.367 178.364 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.948 HD13 ' CD1' ' A' ' 107' ' ' ILE . 18.7 mt -76.02 -33.26 59.66 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -178.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.402 ' CB ' ' HB3' ' A' ' 24' ' ' PRO . 39.4 t -57.18 -19.69 22.16 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.51 HG23 ' CG1' ' A' ' 41' ' ' VAL . 0.2 OUTLIER -101.58 -22.45 14.48 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.346 -179.614 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.573 HD12 ' HB3' ' A' ' 62' ' ' LEU . 39.8 mm -47.87 95.19 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.047 0.451 . . . . 0.0 110.999 -179.673 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -66.73 -26.77 67.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.625 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.766 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 19.1 mttm -148.14 152.6 37.57 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.149 0.5 . . . . 0.0 111.942 -179.227 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.551 HD22 ' N ' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -133.95 128.53 34.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.613 179.178 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -133.58 152.83 51.97 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.067 0.46 . . . . 0.0 111.437 -179.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -148.08 153.19 38.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.729 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 37.4 p -75.8 118.82 73.88 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.548 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -64.1 159.11 44.4 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.491 2.127 . . . . 0.0 112.565 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.93 -41.52 98.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.087 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.7 t -57.92 -27.48 63.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.845 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.9 t -85.97 117.91 25.12 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.83 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -57.15 -18.28 14.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.532 179.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.414 ' HD2' ' CE3' ' B' ' 53' ' ' TRP . 21.0 mmtm -74.94 140.54 43.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.935 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.402 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 10.7 mmm -120.44 115.47 23.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.444 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.64 169.13 1.72 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.112 0.482 . . . . 0.0 111.839 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.419 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -145.73 134.07 21.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.982 179.519 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.408 ' HD2' ' CE1' ' B' ' 54' ' ' PHE . 15.2 mtt180 -125.45 133.1 52.57 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.072 0.463 . . . . 0.0 112.138 -179.136 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.573 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -112.97 131.23 55.84 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.128 179.292 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.766 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.2 mm -99.75 149.99 5.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.77 0.319 . . . . 0.0 111.069 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -120.53 137.74 12.33 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.37 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 24.0 mttp -53.7 141.92 24.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.871 0.367 . . . . 0.0 111.118 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.759 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.4 p -119.57 -161.52 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.799 179.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.759 ' H ' HG22 ' A' ' 66' ' ' VAL . 23.8 t0 -165.76 58.94 0.11 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.399 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -57.78 -22.41 46.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.253 -179.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 40.8 m -61.24 -16.62 47.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.959 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.4 mtmt -74.45 -35.83 63.34 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.087 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.1 mttt 61.96 93.63 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.684 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 25.8 mmt85 -95.79 141.41 29.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.103 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 43.8 mmtt -89.9 145.64 24.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.956 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -93.07 172.21 8.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.839 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -60.32 -19.97 57.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.185 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -86.29 4.29 39.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.405 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.92 15.25 81.43 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.676 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -111.39 144.68 40.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.923 0.392 . . . . 0.0 110.967 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -70.73 148.99 47.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.038 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.46 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.4 m -134.17 158.94 42.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.03 179.815 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 33.6 t -100.23 98.99 8.54 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.103 -0.498 . . . . 0.0 109.781 178.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.46 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 85.3 Cg_exo -40.07 148.14 0.18 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.721 2.281 . . . . 0.0 113.034 -179.02 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.513 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -115.72 107.35 48.68 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.012 -179.938 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.58 ' HD3' HG21 ' A' ' 66' ' ' VAL . 1.8 Cg_endo -39.09 141.88 0.37 Allowed 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 123.543 2.829 . . . . 0.0 112.585 179.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 59.7 mm-40 -65.48 126.34 27.97 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.773 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -122.48 120.42 33.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.931 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.437 ' HB3' ' CE2' ' A' ' 89' ' ' PHE . 94.0 m-70 -98.57 139.23 34.6 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.578 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -121.53 107.86 12.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.256 -179.644 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.597 ' CD1' HD11 ' A' ' 16' ' ' ILE . 95.5 m-85 -114.94 125.43 53.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.462 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.02 136.15 35.69 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.019 0.437 . . . . 0.0 111.136 -179.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.741 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 92.5 m-85 -123.69 158.69 31.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.844 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.402 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 68.8 m-20 -115.56 -19.81 10.44 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.405 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.461 HD22 HG21 ' A' ' 96' ' ' VAL . 93.6 m-20 -107.33 114.64 28.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.797 179.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 9.8 mtt85 -57.83 -29.22 64.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.07 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -77.02 -55.15 5.71 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.361 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.461 HG21 HD22 ' A' ' 93' ' ' ASN . 44.6 t -56.85 -45.29 83.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.934 0.397 . . . . 0.0 110.675 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.411 ' HB3' ' CB ' ' A' ' 91' ' ' PHE . 3.9 ppp? -63.84 -36.81 85.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.053 179.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -62.52 -33.3 74.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.446 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -67.18 -33.73 76.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.987 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.543 HG22 HD12 ' A' ' 104' ' ' LEU . 17.5 mm -69.83 -48.71 62.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.642 179.346 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.428 ' HA ' HD11 ' A' ' 48' ' ' LEU . 8.5 ptpt -64.4 -27.72 69.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.849 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.7 -41.2 31.7 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.447 179.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.48 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -77.21 -30.85 54.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.691 179.876 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.682 ' CD2' HD22 ' A' ' 42' ' ' LEU . 13.5 mt -71.07 -38.63 72.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.788 179.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.722 ' HA ' HD12 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -68.4 -29.24 67.88 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.568 179.792 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -71.28 -33.59 69.89 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.709 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.948 ' CD1' HD13 ' A' ' 42' ' ' LEU . 16.3 mt -70.2 -47.96 64.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.016 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.935 HG22 ' CD ' ' A' ' 112' ' ' LYS . 2.7 mt -57.79 -61.07 1.46 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.631 0 CA-C-O 121.862 0.839 . . . . 0.0 109.224 179.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 27.3 m -50.2 -28.81 8.15 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.376 179.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -65.11 -35.31 80.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.785 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.4 ' CZ ' ' HB2' ' A' ' 43' ' ' SER . 69.1 m-85 -89.53 -31.09 17.79 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.04 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.935 ' CD ' HG22 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -64.48 -34.11 77.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.586 179.615 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 49.1 t0 -59.11 -37.61 77.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.949 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.97 -33.65 75.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.112 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.964 179.974 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 27.7 tp . . . . . 0 N--CA 1.488 1.429 0 CA-C-O 120.747 0.308 . . . . 0.0 111.154 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 2.1 m -128.28 165.83 28.29 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.875 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_exo -51.91 -44.11 47.37 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.568 2.179 . . . . 0.0 112.316 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -58.25 -29.17 65.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.839 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -63.21 -44.09 96.3 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.766 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 35.4 mm -67.29 -25.35 33.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.244 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -64.26 -32.91 74.68 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.882 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.18 -29.25 67.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.2 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 53' ' ' TRP . . . . . 0.414 ' CE3' ' HD2' ' A' ' 57' ' ' LYS . 12.6 m95 -53.56 -29.69 38.32 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.965 0.412 . . . . 0.0 110.894 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 54' ' ' PHE . . . . . 0.408 ' CE1' ' HD2' ' A' ' 61' ' ' ARG . 96.4 m-85 -94.68 -25.08 16.88 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.99 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.439 HG22 ' N ' ' B' ' 56' ' ' GLU . 0.8 OUTLIER -82.24 -55.42 4.55 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.77 179.988 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.439 ' N ' HG22 ' B' ' 55' ' ' THR . 95.9 mt-10 -76.64 148.2 37.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.861 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -122.69 76.97 47.53 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.924 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo . . . . . 0 C--O 1.249 1.037 0 C-N-CA 122.57 2.18 . . . . 0.0 112.34 179.997 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_exo . . . . . 0 N--CA 1.477 0.537 0 CA-C-O 121.137 0.39 . . . . 0.0 111.879 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.6 p -79.07 131.35 36.23 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.854 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.405 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 33.3 m80 65.15 32.97 9.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.229 0.537 . . . . 0.0 111.204 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.562 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 72.6 p 177.65 142.72 0.09 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.665 179.158 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -177.88 114.48 0.46 Allowed Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.327 179.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.649 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -44.72 100.12 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.204 0.526 . . . . 0.0 111.327 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.845 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -115.71 152.03 33.98 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.066 -178.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.567 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -97.7 124.04 50.45 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.193 178.922 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.523 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 18.7 t80 -112.03 130.31 55.91 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.186 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.425 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 38.9 mt-10 56.07 34.92 24.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.872 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 mtpm? 76.18 0.67 3.31 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.25 -178.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.526 ' O ' HG23 ' A' ' 8' ' ' ILE . 41.3 t -99.92 155.41 4.18 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.713 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.567 ' HA ' HG13 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -96.87 149.86 21.39 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 121.379 0.609 . . . . 0.0 112.48 -178.75 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.453 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 174.83 -179.76 45.93 Favored Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.511 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.649 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.96 141.11 22.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 117.68 0.74 . . . . 0.0 110.457 179.307 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.662 HD11 ' CE1' ' A' ' 89' ' ' PHE . 0.1 OUTLIER -106.71 118.31 54.2 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 CA-C-N 115.312 -0.858 . . . . 0.0 108.685 179.737 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.436 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -119.75 138.57 53.24 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.201 -178.605 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.515 HG21 HD11 ' A' ' 107' ' ' ILE . 96.4 mt -112.78 140.08 34.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.327 -178.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -127.08 114.01 17.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.903 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -86.86 5.85 34.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.279 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -79.36 -17.54 54.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.868 0.366 . . . . 0.0 110.426 179.375 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.02 152.0 5.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.984 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.425 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.2 t -129.73 114.74 17.94 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.883 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.425 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 57.5 Cg_endo -72.82 147.25 89.05 Favored 'Cis proline' 0 C--N 1.349 0.578 0 C-N-CA 123.296 -1.543 . . . . 0.0 111.955 0.121 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.713 ' O ' HD22 ' A' ' 42' ' ' LEU . . . -45.44 136.85 5.27 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.557 179.631 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -116.95 152.94 33.51 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.376 0.608 . . . . 0.0 112.03 -178.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.895 ' CB ' HD11 ' A' ' 42' ' ' LEU . 2.9 tt -121.3 130.6 53.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.147 179.166 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.9 m -120.52 127.33 52.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.159 0.504 . . . . 0.0 112.049 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.523 ' CH2' ' HB3' ' A' ' 9' ' ' PHE . 60.6 t90 -100.56 126.77 47.04 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.706 179.044 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 38.1 ttt180 -121.35 116.56 25.04 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.854 0.359 . . . . 0.0 110.875 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.466 ' HG ' ' H ' ' A' ' 36' ' ' LYS . 0.9 OUTLIER -45.48 166.92 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.083 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.87 -42.04 61.34 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 121.541 0.686 . . . . 0.0 109.702 179.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -82.69 -20.68 35.65 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.837 -1.074 . . . . 0.0 111.121 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.47 34.4 12.05 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.292 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -103.9 -19.71 14.15 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 -179.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.466 ' H ' ' HG ' ' A' ' 31' ' ' SER . 0.0 OUTLIER -135.06 144.04 47.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.892 0.377 . . . . 0.0 111.372 -179.855 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 47.5 t -139.52 140.04 37.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.037 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.498 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 80.8 t60 -134.33 146.22 49.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.052 179.704 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.439 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 46.4 m -129.15 135.91 49.49 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.337 -179.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 84.7 t -139.24 140.54 37.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 CA-C-O 121.066 0.46 . . . . 0.0 111.645 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.637 HG22 HG23 ' A' ' 44' ' ' THR . 1.9 p -88.31 117.6 32.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 177.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.895 HD11 ' CB ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -74.28 -35.91 63.76 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -178.277 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.401 ' CB ' ' HB2' ' A' ' 24' ' ' PRO . 8.3 m -50.04 -25.94 3.88 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -178.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.637 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -87.17 -23.52 24.78 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.167 -179.668 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.829 HD12 ' HB3' ' A' ' 62' ' ' LEU . 44.3 mm -50.05 96.66 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.129 0.49 . . . . 0.0 110.917 -179.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.423 ' N ' ' O ' ' A' ' 63' ' ' ILE . 16.7 t0 -72.44 -22.93 61.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.954 -179.232 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.452 ' HB2' HG13 ' A' ' 63' ' ' ILE . 43.4 mttm -157.27 137.91 13.12 Favored 'General case' 0 CA--C 1.522 -0.133 0 C-N-CA 120.422 -0.511 . . . . 0.0 111.949 -179.449 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.629 HD21 HD13 ' A' ' 104' ' ' LEU . 15.3 mt -106.34 124.04 48.99 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.903 178.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 91.9 mm-40 -115.51 133.26 56.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.801 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.428 ' HB2' HD11 ' A' ' 60' ' ' LEU . . . -142.99 146.34 33.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.057 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.676 HG23 ' O ' ' A' ' 59' ' ' MET . 74.9 p -75.63 130.56 78.94 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.687 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -67.02 160.21 48.35 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.49 2.127 . . . . 0.0 112.519 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.07 -42.87 95.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.02 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 87.1 p -60.63 -26.47 67.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.773 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.6 m -77.36 120.16 21.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.861 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -56.98 -18.1 12.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.409 179.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -67.28 155.96 37.57 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.956 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.418 ' HE1' ' O ' ' A' ' 92' ' ' ASN . 44.0 mtp -142.96 80.5 1.69 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.725 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.676 ' O ' HG23 ' A' ' 51' ' ' THR . 10.4 tmm? -162.35 149.37 13.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.453 -179.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.428 HD11 ' HB2' ' A' ' 50' ' ' ALA . 0.2 OUTLIER -116.35 152.98 32.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.479 179.771 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.446 ' HB2' ' CE2' ' B' ' 54' ' ' PHE . 56.2 ttt180 -137.91 135.41 36.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.995 0.426 . . . . 0.0 111.886 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.829 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -103.53 144.24 31.68 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.384 179.501 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.452 HG13 ' HB2' ' A' ' 47' ' ' LYS . 1.2 mm -116.47 122.65 70.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.059 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.63 151.92 20.56 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.415 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.8 mttt -70.47 136.41 49.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.845 0.355 . . . . 0.0 111.001 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.488 ' CG2' ' N ' ' A' ' 67' ' ' ASP . 1.4 p -70.15 160.51 5.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.299 0.571 . . . . 0.0 111.312 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.488 ' N ' ' CG2' ' A' ' 66' ' ' VAL . 0.5 OUTLIER -113.18 130.69 56.13 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.784 179.901 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -95.0 3.63 54.71 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.453 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 24.0 t -72.08 -9.99 59.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.326 -179.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.71 -69.1 0.77 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.757 0.313 . . . . 0.0 111.176 -179.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.6 mmtt 62.47 94.23 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.788 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 16.6 mtt-85 -108.17 153.13 23.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.037 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.5 mmtp -93.28 147.73 22.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.986 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -90.47 176.71 6.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.005 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -63.75 -18.67 64.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.272 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -88.57 -5.89 57.9 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.344 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 91.88 9.52 62.4 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.711 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 -105.95 145.15 31.67 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.892 0.377 . . . . 0.0 110.965 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -72.3 144.08 48.48 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.915 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.44 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.3 m -132.3 158.82 43.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.175 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 32.5 t -101.5 98.8 9.95 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.678 178.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.44 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 99.2 Cg_exo -42.0 158.54 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.597 2.198 . . . . 0.0 112.743 -179.113 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.447 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.1 OUTLIER -69.86 149.96 96.51 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-O 121.115 0.483 . . . . 0.0 111.055 -179.874 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 16.8 Cg_exo -72.34 164.14 36.52 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 123.473 2.782 . . . . 0.0 112.622 -179.073 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 -65.55 157.36 29.93 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.692 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 62.3 mtm180 -150.11 119.82 7.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.799 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.433 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 36.2 m-70 -105.32 159.06 16.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.465 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.571 ' HG3' HG21 ' B' ' 50' ' ' ILE . 0.0 OUTLIER -126.67 144.6 50.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.213 0.53 . . . . 0.0 111.681 -179.503 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.662 ' CE1' HD11 ' A' ' 16' ' ' ILE . 97.7 m-85 -157.51 125.21 5.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.119 179.406 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 22.6 t -109.36 139.86 43.79 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.899 0.381 . . . . 0.0 111.387 -179.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.845 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 0.8 OUTLIER -126.76 146.57 50.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.521 179.681 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.418 ' O ' ' HE1' ' A' ' 58' ' ' MET . 10.9 m120 -87.21 -18.04 31.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.312 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.461 ' HB2' HG23 ' A' ' 96' ' ' VAL . 94.8 m-20 -109.43 119.43 39.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.819 0.343 . . . . 0.0 110.741 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.62 -31.83 66.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.986 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.91 -46.73 73.92 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.168 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.461 HG23 ' HB2' ' A' ' 93' ' ' ASN . 48.3 t -59.86 -34.2 55.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.484 179.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.478 ' HG2' ' CG ' ' A' ' 91' ' ' PHE . 0.2 OUTLIER -63.59 -37.55 87.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.523 179.568 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -71.06 -36.61 72.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.86 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -60.22 -47.39 86.16 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.762 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.524 HG22 HD12 ' A' ' 104' ' ' LEU . 24.5 mm -65.46 -48.98 80.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.888 179.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.23 -27.61 68.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.898 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 44.6 mtm -78.65 -37.79 41.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.466 179.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.485 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -79.43 -38.97 33.49 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.744 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.629 HD13 HD21 ' A' ' 48' ' ' LEU . 30.2 mt -64.7 -39.62 93.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.591 179.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.593 ' HA ' HD12 ' A' ' 108' ' ' ILE . 48.3 mt-30 -61.92 -31.09 71.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.519 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -68.52 -35.45 77.49 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.666 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.664 HG21 ' HB2' ' A' ' 42' ' ' LEU . 58.2 mt -68.22 -48.49 73.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.957 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.807 HG22 ' HD3' ' A' ' 112' ' ' LYS . 2.7 mt -59.93 -61.07 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.508 -0.668 0 CA-C-O 121.663 0.744 . . . . 0.0 109.06 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.5 m -49.74 -28.94 6.81 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.248 -1.342 . . . . 0.0 110.81 179.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 31.3 mtt-85 -66.97 -34.8 78.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.707 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -96.41 -30.62 13.27 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.888 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.807 ' HD3' HG22 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -68.68 -37.53 79.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.626 179.693 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -61.12 -37.3 82.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.887 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.02 -33.95 76.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.13 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 86.9 m-20 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.272 -0.87 . . . . 0.0 110.937 179.962 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 52.0 mt . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.855 0.36 . . . . 0.0 111.199 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 16.2 p -117.42 159.49 41.57 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.9 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -52.82 -39.33 77.93 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.603 2.202 . . . . 0.0 112.319 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -56.33 -26.46 52.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.962 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -63.07 -41.72 99.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.779 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.571 HG21 ' HG3' ' A' ' 88' ' ' MET . 36.9 mm -68.77 -27.02 34.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.242 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -66.27 -34.45 78.02 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.921 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.87 -31.44 72.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.858 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 53' ' ' TRP . . . . . . . . . . . . . 12.3 m95 -58.5 -34.73 71.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.98 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 54' ' ' PHE . . . . . 0.446 ' CE2' ' HB2' ' A' ' 61' ' ' ARG . 89.5 m-85 -101.82 -13.77 17.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.215 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -89.09 -25.99 21.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.967 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -56.04 145.83 24.44 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.08 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -105.08 155.34 37.84 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.872 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo . . . . . 0 C--O 1.25 1.111 0 C-N-CA 122.538 2.159 . . . . 0.0 112.307 179.974 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo . . . . . 0 N--CA 1.476 0.451 0 CA-C-O 120.887 0.286 . . . . 0.0 111.781 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.0 m -158.33 -50.18 0.06 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.847 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.412 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 78.0 m80 -137.9 34.02 2.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.174 0.511 . . . . 0.0 110.828 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.521 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 49.9 p 179.97 120.43 0.06 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.709 179.103 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.417 ' O ' ' C ' ' A' ' 6' ' ' ALA . . . -147.4 115.75 0.79 Allowed Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.781 -0.723 . . . . 0.0 111.963 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.554 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -34.2 118.68 0.39 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.794 0.33 . . . . 0.0 111.116 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.583 ' CB ' HD12 ' A' ' 16' ' ' ILE . . . -133.46 150.98 51.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.075 -178.734 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.613 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.4 mp -99.83 124.57 53.31 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 CA-C-O 121.157 0.503 . . . . 0.0 110.521 179.227 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.504 ' HB3' ' CZ3' ' A' ' 29' ' ' TRP . 18.2 t80 -116.62 132.53 56.66 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.033 179.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.426 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 89.7 mt-10 57.41 33.48 23.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.741 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.5 mttm 75.29 1.24 3.65 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.001 -178.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.483 ' O ' HG23 ' A' ' 8' ' ' ILE . 25.0 t -101.0 144.37 12.94 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.769 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.752 179.078 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.613 ' HA ' HG13 ' A' ' 8' ' ' ILE . 81.0 p -83.72 145.6 28.65 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.278 -179.568 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.442 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . -174.3 -179.12 44.71 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.844 -179.377 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.554 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 4.5 mm -105.37 135.27 44.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-O 120.914 0.388 . . . . 0.0 110.373 179.74 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.583 HD12 ' CB ' ' A' ' 7' ' ' ALA . 0.2 OUTLIER -106.44 118.01 53.3 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.884 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 178.634 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.459 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -122.08 128.69 51.63 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.345 0.593 . . . . 0.0 111.84 -177.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.412 ' O ' ' HB3' ' A' ' 3' ' ' HIS . 59.8 mt -101.77 140.01 21.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.787 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.461 ' ND2' HG21 ' A' ' 22' ' ' VAL . 50.2 p-10 -131.27 111.47 11.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.999 0.428 . . . . 0.0 111.168 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -92.4 4.01 54.29 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.419 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -78.35 -17.71 56.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.962 0.41 . . . . 0.0 110.414 179.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.461 HG21 ' ND2' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -100.88 151.32 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.015 -179.719 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.44 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.1 t -123.67 117.56 27.53 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.642 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.453 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 1.6 Cg_endo -79.74 145.65 73.81 Favored 'Cis proline' 0 C--N 1.348 0.517 0 C-N-CA 123.678 -1.384 . . . . 0.0 112.044 0.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.21 145.86 2.11 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.714 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -137.41 167.05 22.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.307 0.575 . . . . 0.0 111.983 -179.126 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.592 ' C ' HD23 ' A' ' 27' ' ' LEU . 5.4 tt -125.86 124.67 41.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.388 179.2 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.5 m -116.69 130.53 56.79 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.147 0.499 . . . . 0.0 112.056 -178.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.504 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 58.7 t90 -100.63 129.01 46.49 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.241 179.096 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 45.4 ttt-85 -127.75 116.99 21.07 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.504 179.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.401 ' HA ' ' CA ' ' A' ' 14' ' ' GLY . 14.5 m -44.66 155.96 0.09 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.952 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.42 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.1 OUTLIER -65.4 -39.35 92.07 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.638 0.732 . . . . 0.0 109.25 179.978 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -85.03 -23.1 28.76 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 114.68 -1.146 . . . . 0.0 111.129 179.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.85 32.06 10.43 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.601 179.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -94.71 -21.86 18.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.592 0.234 . . . . 0.0 111.48 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.47 147.02 44.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.902 0.382 . . . . 0.0 111.17 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 14.7 p -139.13 138.14 41.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.126 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.487 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 32.7 t60 -136.44 145.87 45.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.984 0.421 . . . . 0.0 111.173 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 40.3 m -129.2 137.25 51.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.998 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 88.2 t -134.1 140.85 45.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 121.186 0.517 . . . . 0.0 111.754 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.598 HG22 HG23 ' A' ' 44' ' ' THR . 1.7 p -87.95 117.77 32.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 178.024 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.998 HD13 HD13 ' A' ' 107' ' ' ILE . 58.2 mt -75.21 -29.66 60.39 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -178.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.453 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 8.1 t -55.86 -22.16 23.76 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.598 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -94.8 -21.63 18.59 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.137 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.868 HD12 ' HB3' ' A' ' 62' ' ' LEU . 39.3 mm -57.95 88.26 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.983 0.421 . . . . 0.0 110.922 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -70.04 -29.06 66.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.383 -179.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.68 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 18.2 mttm -138.99 142.36 38.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.969 0.414 . . . . 0.0 111.575 -179.294 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.722 HD23 ' HG2' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -124.71 124.41 42.11 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.609 179.134 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -116.82 139.32 50.74 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.049 -179.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.509 ' HB3' ' CE ' ' A' ' 101' ' ' LYS . . . -143.39 144.22 31.96 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.969 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 32.3 p -75.65 113.44 26.67 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.548 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.46 160.57 35.02 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.545 2.164 . . . . 0.0 112.643 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.01 -42.97 77.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.243 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.5 m -58.29 -27.63 64.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.725 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 23.4 t -85.06 118.2 24.49 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.891 179.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -56.22 -18.7 11.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.583 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.432 ' HD2' ' CE3' ' B' ' 53' ' ' TRP . 39.6 mmtm -65.44 159.03 25.18 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.871 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.438 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 26.8 mtp -142.92 79.92 1.67 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.819 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.455 ' CE ' ' CE3' ' B' ' 53' ' ' TRP . 29.3 mtm -154.7 169.09 24.72 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.152 0.501 . . . . 0.0 111.633 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.453 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -140.79 123.88 16.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.529 -0.759 . . . . 0.0 109.955 179.502 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 47.1 ttt180 -113.43 137.11 52.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.853 0.358 . . . . 0.0 111.789 -179.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.868 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -112.61 144.08 42.71 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.624 179.749 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.68 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 2.0 mm -114.79 124.32 71.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.025 179.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -90.37 129.93 9.99 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.466 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 48.3 mttt -45.9 152.43 0.37 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.738 0.304 . . . . 0.0 111.284 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.704 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.0 OUTLIER -122.23 -162.89 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.865 -179.944 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.704 ' H ' HG22 ' A' ' 66' ' ' VAL . 9.7 t0 179.67 51.52 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.402 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.598 ' OE2' HG12 ' A' ' 81' ' ' VAL . 50.8 mt-10 -57.5 -22.3 43.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.402 -179.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.9 m -63.89 -14.26 52.01 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.135 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.2 mtmt -70.14 -45.47 66.75 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.846 0.355 . . . . 0.0 111.307 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.1 mttm 61.42 93.31 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.672 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.83 151.44 25.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.001 -179.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.6 mmtm -86.16 145.44 27.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.076 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 43.7 p30 -95.77 177.45 5.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.896 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -60.28 -19.98 57.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.337 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -88.45 9.75 22.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.513 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 70.31 17.86 74.6 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.696 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -115.52 145.87 42.23 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.862 0.363 . . . . 0.0 110.754 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 55.7 mp0 -74.56 142.5 44.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.97 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.478 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 2.0 m -131.36 158.88 43.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.01 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.598 HG12 ' OE2' ' A' ' 68' ' ' GLU . 15.4 t -102.29 98.52 10.67 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.712 178.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.478 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 87.2 Cg_exo -45.83 163.49 0.09 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.493 2.129 . . . . 0.0 112.578 -179.089 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.462 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 21.5 mtpp -117.99 147.74 41.96 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.97 0.414 . . . . 0.0 110.991 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 16.5 Cg_exo -72.7 136.27 25.29 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 123.363 2.708 . . . . 0.0 112.665 -179.045 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 40.0 mm-40 -67.01 149.32 50.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.72 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.2 mtp85 -151.59 120.0 6.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.747 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -104.59 144.94 31.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.769 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.4 ttt -122.94 118.34 27.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.887 0.375 . . . . 0.0 111.224 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.492 ' CE1' ' CD1' ' A' ' 9' ' ' PHE . 93.7 m-85 -124.98 141.94 51.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.521 179.713 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 1.3 p -114.0 135.67 53.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.899 0.38 . . . . 0.0 111.054 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.496 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 23.8 m-85 -122.47 156.48 34.01 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.75 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.438 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 57.6 m-20 -118.78 20.3 12.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.111 179.713 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -147.9 110.2 4.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.844 0.354 . . . . 0.0 110.669 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 15.5 mtt-85 -54.46 -29.33 49.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.066 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -75.79 -55.04 6.01 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.356 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 46.6 t -56.08 -47.41 80.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.622 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.5 ppp? -63.06 -35.55 80.62 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.84 179.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -61.12 -35.19 76.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.397 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -67.9 -35.38 78.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.197 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.44 HG22 HD12 ' A' ' 104' ' ' LEU . 18.3 mm -70.73 -52.07 31.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.719 179.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.517 ' CG ' HD11 ' A' ' 48' ' ' LEU . 0.6 OUTLIER -61.58 -28.04 69.06 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.862 179.85 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 46.3 mtm -78.46 -40.81 34.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.655 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.15 -31.84 49.96 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.624 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.702 ' HA ' HD12 ' A' ' 107' ' ' ILE . 14.0 mt -65.94 -39.89 90.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.887 0.375 . . . . 0.0 110.661 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.777 ' HA ' HD12 ' A' ' 108' ' ' ILE . 1.4 mt-30 -63.1 -28.43 70.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.037 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -70.25 -36.85 74.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.052 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.998 HD13 HD13 ' A' ' 42' ' ' LEU . 6.0 mt -69.47 -46.98 74.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.356 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.817 HG22 ' CD ' ' A' ' 112' ' ' LYS . 2.3 mt -57.22 -61.11 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.597 0 CA-C-O 121.696 0.76 . . . . 0.0 109.584 179.278 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 29.9 m -51.51 -28.68 14.21 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.458 179.049 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 4.3 mtt-85 -66.27 -35.35 80.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.787 179.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.406 ' CZ ' ' HB2' ' A' ' 43' ' ' SER . 79.8 m-85 -93.13 -34.48 13.62 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.954 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.817 ' CD ' HG22 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -65.35 -37.09 85.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.982 0.42 . . . . 0.0 110.748 179.789 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -60.95 -38.68 86.73 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.0 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.04 -35.13 80.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.133 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 51.8 t0 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.218 -0.896 . . . . 0.0 111.002 179.873 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 7.3 tt . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.853 0.358 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 15.2 p -123.62 164.7 27.0 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.833 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_exo -51.83 -43.42 51.73 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.554 2.169 . . . . 0.0 112.35 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -59.02 -28.82 66.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.996 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -73.26 -49.1 29.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.164 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 34.4 mm -56.42 -31.66 33.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.528 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 19.0 pt-20 -80.48 -26.05 38.46 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.921 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.56 -30.72 70.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.637 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 53' ' ' TRP . . . . . 0.455 ' CE3' ' CE ' ' A' ' 59' ' ' MET . 13.0 m0 -58.05 -36.06 72.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.998 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 54' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -93.87 -0.77 55.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.434 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -76.39 -30.8 57.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.756 0.312 . . . . 0.0 110.812 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -59.7 138.31 57.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.903 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -167.56 75.13 0.97 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.923 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo . . . . . 0 C--O 1.249 1.042 0 C-N-CA 122.532 2.155 . . . . 0.0 112.234 -179.914 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.401 ' CB ' ' ND2' ' A' ' 99' ' ' ASN . 12.0 Cg_endo . . . . . 0 N--CA 1.477 0.551 0 CA-C-O 120.873 0.281 . . . . 0.0 111.797 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.8 m -148.03 123.68 10.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.024 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.458 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 52.3 m80 64.53 29.05 13.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.207 0.527 . . . . 0.0 111.367 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.502 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 0.9 OUTLIER -172.69 139.97 0.96 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.549 179.022 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.402 ' CA ' ' CG1' ' A' ' 96' ' ' VAL . . . -171.49 118.27 0.73 Allowed Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.319 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.647 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -47.84 100.2 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.18 0.514 . . . . 0.0 111.212 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.829 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -114.63 152.19 32.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.914 -178.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.555 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -100.57 123.72 53.68 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.259 0 CA-C-O 120.956 0.408 . . . . 0.0 110.414 178.998 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.502 ' HB3' ' CZ3' ' A' ' 29' ' ' TRP . 14.4 t80 -111.3 131.16 55.37 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.173 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.43 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 37.1 mt-10 54.85 34.94 23.15 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.936 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.5 mttm 75.84 1.78 3.58 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.35 -179.178 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.522 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.9 t -100.04 154.6 4.33 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.69 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 178.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.555 ' HA ' HG13 ' A' ' 8' ' ' ILE . 94.4 p -97.01 149.62 21.71 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.674 0.75 . . . . 0.0 112.776 -178.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.436 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 174.38 -179.84 45.46 Favored Glycine 0 N--CA 1.447 -0.623 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.241 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.647 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -107.15 141.93 21.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 117.801 0.801 . . . . 0.0 110.583 179.407 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.88 HG12 HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -106.73 118.43 54.44 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 CA-C-N 115.283 -0.871 . . . . 0.0 108.653 179.527 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.468 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -120.53 131.2 54.58 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.223 0.535 . . . . 0.0 111.213 -178.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.646 HG23 HD11 ' A' ' 42' ' ' LEU . 76.9 mt -103.25 140.22 22.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.207 -179.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -131.54 111.46 11.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.882 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -90.61 6.35 44.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.214 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -79.28 -17.88 53.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.9 0.381 . . . . 0.0 110.448 179.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -100.25 143.04 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.095 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.446 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 3.0 t -115.33 116.47 41.79 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.722 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.459 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 1.5 Cg_endo -80.8 143.24 61.68 Favored 'Cis proline' 0 C--N 1.348 0.525 0 C-N-CA 123.816 -1.327 . . . . 0.0 111.956 -0.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.26 142.42 2.91 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.053 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -135.61 167.3 21.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.191 0.519 . . . . 0.0 111.57 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.88 HD21 HG12 ' A' ' 16' ' ' ILE . 4.8 tt -121.04 130.94 53.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.806 179.595 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 48.0 m -117.74 126.01 51.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.199 0.524 . . . . 0.0 112.074 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.502 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 56.9 t90 -100.58 129.09 46.47 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.075 179.07 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 26.2 ttt85 -123.94 117.57 25.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.91 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.413 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 17.9 t -45.51 166.53 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.102 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.77 -42.64 57.81 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-O 121.452 0.644 . . . . 0.0 109.62 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -86.46 -16.62 36.54 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.079 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.8 34.24 13.82 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.238 -179.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -97.75 -21.62 16.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.573 0.225 . . . . 0.0 111.6 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.458 ' NZ ' HG21 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -138.99 146.76 41.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.027 0.442 . . . . 0.0 111.597 -179.892 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 47.5 t -139.56 140.49 36.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.769 179.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.5 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 38.1 t60 -135.55 145.58 47.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.023 0.44 . . . . 0.0 111.321 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 47.7 m -129.32 135.27 48.52 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.86 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.4 t -130.84 140.89 47.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 121.142 0.496 . . . . 0.0 111.612 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.623 HG22 HG23 ' A' ' 44' ' ' THR . 2.0 p -86.41 117.78 31.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 178.214 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 1.043 HD13 HD13 ' A' ' 107' ' ' ILE . 66.3 mt -75.39 -30.68 60.21 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.259 -0.428 . . . . 0.0 112.092 -178.618 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.459 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 11.4 t -55.64 -21.88 20.03 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 -178.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.623 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -94.41 -21.57 18.86 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.718 0.294 . . . . 0.0 111.36 -179.673 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.716 HD12 ' HB3' ' A' ' 62' ' ' LEU . 37.3 mm -51.76 92.71 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.97 0.414 . . . . 0.0 111.091 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -66.07 -29.73 70.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.109 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.634 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 18.2 mttp -153.35 158.99 42.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.977 0.418 . . . . 0.0 111.302 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.517 HD23 ' HG3' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -131.66 128.82 39.86 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.948 179.381 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -119.92 144.97 47.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.93 0.395 . . . . 0.0 111.072 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.812 ' HB2' HD12 ' A' ' 60' ' ' LEU . . . -148.06 141.63 25.47 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.033 179.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.53 HG21 ' HB3' ' A' ' 57' ' ' LYS . 73.3 p -75.69 117.17 61.6 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.587 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -62.05 160.56 29.57 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.519 2.146 . . . . 0.0 112.564 -179.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.67 -43.11 80.08 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.095 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 84.3 p -62.32 -27.48 69.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.053 0.454 . . . . 0.0 110.558 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.4 m -79.72 120.52 24.13 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.844 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.4 tp10 -55.62 -19.02 8.98 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.453 179.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.53 ' HB3' HG21 ' A' ' 51' ' ' THR . 0.0 OUTLIER -71.51 141.13 50.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.9 179.859 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 63.5 mtp -131.25 79.81 1.9 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.542 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 38.3 mtm -155.79 169.09 25.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.163 0.506 . . . . 0.0 111.527 -179.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.812 HD12 ' HB2' ' A' ' 50' ' ' ALA . 4.7 tp -134.17 124.03 25.34 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.113 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.439 ' HB2' ' CZ ' ' B' ' 54' ' ' PHE . 53.2 ttt180 -112.27 126.53 55.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.938 0.399 . . . . 0.0 111.783 -179.369 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.716 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -105.47 143.7 33.27 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.38 179.423 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.634 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.5 mm -108.78 121.98 62.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.744 0.307 . . . . 0.0 111.174 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -90.5 128.09 9.11 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.206 179.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 23.6 mttt -50.04 146.09 5.14 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.879 0.371 . . . . 0.0 111.164 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.737 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.4 p -111.14 -162.15 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.051 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.737 ' H ' HG22 ' A' ' 66' ' ' VAL . 7.2 m-20 -173.03 71.62 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.245 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.453 ' OE2' HG21 ' A' ' 81' ' ' VAL . 49.9 mt-10 -55.73 -22.28 22.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.437 -179.497 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 26.8 t -59.35 -17.48 30.11 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.085 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 62.3 mmtt -64.8 -45.28 86.91 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.794 0.33 . . . . 0.0 111.025 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.3 mptt 61.63 94.08 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.747 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.404 ' CG ' ' HG3' ' A' ' 82' ' ' PRO . 26.2 mmt180 -90.74 165.77 13.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.888 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.8 mttp -125.54 147.4 49.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.129 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -78.35 172.43 13.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.746 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -57.67 -24.0 54.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.227 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 48.8 mp0 -95.1 19.59 10.27 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.28 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.52 9.23 84.62 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.901 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -67.3 -163.5 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.696 0.284 . . . . 0.0 110.799 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -137.95 138.19 38.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.715 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.482 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 1.8 m -140.62 156.32 23.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.221 0.534 . . . . 0.0 111.376 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.477 HG13 ' O ' ' A' ' 81' ' ' VAL . 3.0 p -99.12 98.96 7.16 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 114.993 -1.003 . . . . 0.0 109.916 179.257 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.482 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 96.8 Cg_exo -41.9 145.32 0.77 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.663 2.242 . . . . 0.0 112.853 -178.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.451 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 3.4 mmpt? -94.45 153.12 40.44 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.995 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 19.0 Cg_exo -71.55 141.65 38.67 Favored 'Trans proline' 0 N--CA 1.466 -0.133 0 C-N-CA 123.406 2.737 . . . . 0.0 112.7 -179.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -65.55 147.26 53.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.859 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.419 ' HE ' HG23 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -149.63 119.8 7.26 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.668 179.931 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -100.62 156.93 17.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.709 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.8 ttt -133.53 126.82 31.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.237 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.636 ' CE1' HD11 ' A' ' 16' ' ' ILE . 90.2 m-85 -134.22 148.19 50.82 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.518 179.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 38.7 t -128.56 133.1 48.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.952 0.406 . . . . 0.0 111.356 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.829 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 0.7 OUTLIER -123.38 160.99 25.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.286 179.679 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 36.1 m-20 -114.3 28.36 8.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.846 0.355 . . . . 0.0 110.876 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.592 ' ND2' HG23 ' A' ' 96' ' ' VAL . 44.9 t-20 -152.7 110.12 3.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.608 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.84 -31.17 37.68 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.016 0.436 . . . . 0.0 110.892 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.61 -54.87 11.91 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.944 179.808 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.592 HG23 ' ND2' ' A' ' 93' ' ' ASN . 50.8 t -58.76 -35.73 57.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.06 0.457 . . . . 0.0 110.332 179.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.484 ' HG3' ' CD1' ' A' ' 91' ' ' PHE . 1.7 ttp -66.74 -38.56 86.89 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.641 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.5 ' O ' ' HB3' ' A' ' 102' ' ' MET . 52.0 t0 -69.36 -35.32 75.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.769 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.401 ' ND2' ' CB ' ' A' ' 1' ' ' PRO . 76.9 m-20 -61.57 -35.64 78.39 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.154 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.514 HG21 HD22 ' A' ' 60' ' ' LEU . 18.1 mm -71.69 -50.86 36.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.791 179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.485 ' O ' HD21 ' A' ' 48' ' ' LEU . 1.0 OUTLIER -63.24 -27.37 69.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.798 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.5 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.7 OUTLIER -78.51 -41.74 31.52 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.201 179.626 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.603 ' CG2' HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -71.92 -40.08 69.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.804 -179.999 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.649 ' HA ' HD12 ' A' ' 107' ' ' ILE . 13.6 mt -61.62 -38.8 88.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.764 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.779 ' HA ' HD12 ' A' ' 108' ' ' ILE . 5.2 mt-30 -63.42 -27.07 69.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.96 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -70.08 -34.07 72.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.124 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.043 HD13 HD13 ' A' ' 42' ' ' LEU . 3.8 mt -74.22 -45.83 46.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.561 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.863 HG22 ' HD3' ' A' ' 112' ' ' LYS . 2.3 mt -56.64 -61.25 1.28 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.542 0 CA-C-O 121.734 0.778 . . . . 0.0 109.5 179.388 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.1 t -49.45 -28.87 5.74 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.783 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 7.2 mtt-85 -67.5 -35.33 78.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.625 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -93.41 -31.88 14.45 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.729 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.863 ' HD3' HG22 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -65.54 -36.69 84.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.523 179.676 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -60.61 -36.91 79.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.924 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.26 -33.41 74.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.087 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 23.0 t70 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.92 179.972 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 63.8 mt . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 120.826 0.346 . . . . 0.0 111.107 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.4 m -131.39 166.81 25.2 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.952 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_exo -51.72 -35.79 59.37 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.598 2.199 . . . . 0.0 112.369 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -54.63 -25.89 29.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.876 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -63.17 -45.34 92.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.801 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 38.0 mm -68.72 -22.44 26.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.309 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -63.68 -32.76 74.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.882 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.73 -30.7 67.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.978 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 53' ' ' TRP . . . . . 0.449 ' CE3' ' CG ' ' A' ' 57' ' ' LYS . 15.2 m95 -53.99 -25.29 20.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.946 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 54' ' ' PHE . . . . . 0.439 ' CZ ' ' HB2' ' A' ' 61' ' ' ARG . 96.2 m-85 -106.86 -22.19 12.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.153 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -81.96 -33.69 30.12 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.877 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -59.97 140.28 56.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.973 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -128.73 163.62 43.94 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.908 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo . . . . . 0 C--O 1.249 1.056 0 C-N-CA 122.643 2.228 . . . . 0.0 112.324 179.92 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo . . . . . 0 N--CA 1.477 0.519 0 CA-C-O 120.873 0.28 . . . . 0.0 111.861 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.3 m -95.14 132.3 40.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.86 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.418 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 25.3 m80 64.37 30.52 13.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.173 0.511 . . . . 0.0 110.999 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.559 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 88.4 p 174.91 126.69 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.634 178.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.419 ' O ' ' C ' ' A' ' 6' ' ' ALA . . . -163.6 110.37 0.42 Allowed Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.868 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.584 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -33.11 116.33 0.23 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.812 0.339 . . . . 0.0 111.261 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.691 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -133.63 151.84 51.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.081 -0.508 . . . . 0.0 112.08 -178.744 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.599 HG13 ' HA ' ' A' ' 13' ' ' SER . 1.0 OUTLIER -97.62 125.12 50.85 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.226 0 CA-C-O 121.062 0.458 . . . . 0.0 110.56 179.203 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.508 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 25.2 t80 -116.65 128.52 55.45 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.912 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.421 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 88.7 mt-10 59.31 33.58 22.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.721 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.7 mttt 75.94 1.87 3.56 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.183 -178.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.501 HG21 ' HE2' ' A' ' 36' ' ' LYS . 35.2 t -101.13 152.07 5.22 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.755 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 178.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.599 ' HA ' HG13 ' A' ' 8' ' ' ILE . 83.4 p -90.65 146.0 24.39 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 121.377 0.608 . . . . 0.0 111.518 -179.384 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.444 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -177.07 -179.17 47.31 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.702 -179.565 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.584 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 5.4 mm -105.21 136.2 40.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 120.859 0.362 . . . . 0.0 110.285 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.872 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.58 117.89 53.23 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 178.934 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.473 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -124.17 133.73 53.49 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.359 -178.118 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.769 HG23 HD11 ' A' ' 42' ' ' LEU . 82.6 mt -105.8 140.0 25.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.353 -179.031 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -131.36 114.81 15.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.841 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -92.83 5.33 51.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.364 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -78.95 -17.97 54.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.035 0.445 . . . . 0.0 110.383 179.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.25 143.48 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.866 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.8 m -117.78 119.66 33.69 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.861 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.433 ' HB3' ' HB3' ' A' ' 43' ' ' SER . 3.4 Cg_exo -78.71 141.1 62.53 Favored 'Cis proline' 0 C--N 1.348 0.548 0 C-N-CA 123.621 -1.408 . . . . 0.0 111.786 -0.151 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -43.59 137.68 2.83 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.01 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.409 ' HA ' ' HG ' ' A' ' 42' ' ' LEU . 72.3 mt-10 -130.24 165.04 23.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.159 0.504 . . . . 0.0 111.835 -179.049 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.872 HD21 HG12 ' A' ' 16' ' ' ILE . 7.0 tt -121.12 125.68 47.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.472 179.099 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.6 m -113.29 128.9 56.62 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.486 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 58.9 t90 -100.56 126.63 47.03 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.931 178.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.46 117.81 25.24 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.653 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 29.7 t -44.42 157.29 0.06 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.882 -179.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.444 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 0.2 OUTLIER -65.18 -39.11 92.44 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.624 0.726 . . . . 0.0 109.146 179.863 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 -85.24 -23.95 28.0 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.629 -1.169 . . . . 0.0 111.017 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 91.28 31.69 9.47 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.615 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -100.0 -19.94 16.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.696 0.284 . . . . 0.0 111.437 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.501 ' HE2' HG21 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -131.62 141.49 49.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.825 0.345 . . . . 0.0 111.092 -179.926 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 13.5 p -139.13 135.02 41.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.27 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.508 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 70.8 t60 -135.07 146.32 48.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.201 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 40.0 m -126.58 140.52 52.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.077 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 93.3 t -134.68 140.93 44.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 121.118 0.485 . . . . 0.0 111.698 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.6 HG22 HG23 ' A' ' 44' ' ' THR . 1.5 p -86.02 118.09 31.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 1.152 HD13 HD13 ' A' ' 107' ' ' ILE . 46.3 mt -74.53 -30.15 61.66 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -178.313 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.433 ' HB3' ' HB3' ' A' ' 24' ' ' PRO . 60.2 p -56.14 -22.06 26.27 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -178.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.6 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -90.82 -24.29 20.34 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.883 0.373 . . . . 0.0 111.331 -179.596 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.955 HD12 ' HB3' ' A' ' 62' ' ' LEU . 42.3 mm -57.78 92.04 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.806 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -80.42 -26.11 38.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.734 -179.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.691 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 19.4 mtmt -137.61 152.83 49.79 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.201 0.524 . . . . 0.0 112.049 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.818 HD21 ' HB3' ' A' ' 104' ' ' LEU . 22.2 mt -116.28 124.41 50.11 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.032 179.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.406 ' CB ' ' HG3' ' A' ' 61' ' ' ARG . 10.4 mp0 -121.91 130.31 53.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.893 0.378 . . . . 0.0 110.823 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.918 ' HB2' HD12 ' A' ' 60' ' ' LEU . . . -144.66 143.92 30.98 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.965 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.477 HG23 ' O ' ' A' ' 59' ' ' MET . 72.7 p -75.67 123.74 88.52 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.46 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -61.1 154.54 56.57 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.597 2.198 . . . . 0.0 112.537 -179.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.17 -42.49 98.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.125 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.6 t -58.07 -27.61 63.8 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.05 0.452 . . . . 0.0 110.831 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.6 t -80.21 119.16 22.6 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.808 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -55.95 -18.65 9.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.521 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.455 ' HD2' ' CD2' ' B' ' 53' ' ' TRP . 5.3 mttm -81.4 126.23 31.36 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.94 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.49 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 28.4 mtp -107.93 117.62 34.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.593 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.477 ' O ' HG23 ' A' ' 51' ' ' THR . 1.7 ttm -174.59 167.97 3.79 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.185 0.517 . . . . 0.0 111.791 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.918 HD12 ' HB2' ' A' ' 50' ' ' ALA . 1.6 tp -153.58 138.97 17.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.918 179.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.444 ' HG2' ' CZ ' ' B' ' 54' ' ' PHE . 0.2 OUTLIER -139.98 148.09 41.39 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.005 0.431 . . . . 0.0 111.869 -179.649 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.955 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -109.47 144.34 37.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.582 179.919 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.691 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 2.5 mm -105.82 121.72 58.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.766 0.317 . . . . 0.0 111.112 179.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -86.07 131.39 10.48 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.313 179.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.4 mttt -46.34 150.63 0.61 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.702 0.287 . . . . 0.0 111.334 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.7 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.3 p -116.86 -162.09 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.973 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.7 ' H ' HG22 ' A' ' 66' ' ' VAL . 25.9 m-20 -166.29 59.8 0.1 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.324 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.616 ' HB3' HG13 ' A' ' 81' ' ' VAL . 86.7 mt-10 -57.44 -21.5 37.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.411 -179.658 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 32.7 t -58.6 -18.23 28.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.116 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -67.56 -51.43 50.77 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.887 0.375 . . . . 0.0 110.956 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.6 mttt 57.65 88.12 0.06 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.033 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.71 135.33 39.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.811 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 18.1 mmtm -75.24 144.84 42.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.313 -179.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -95.23 174.15 7.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.87 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -59.6 -19.88 51.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.324 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 49.3 mp0 -87.66 7.69 28.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.434 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.05 18.59 79.24 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.6 -0.81 . . . . 0.0 112.685 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -115.56 145.51 42.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.746 0.307 . . . . 0.0 111.024 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -76.45 146.32 38.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.897 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.441 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 1.3 m -133.7 158.72 42.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.213 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.616 HG13 ' HB3' ' A' ' 68' ' ' GLU . 16.2 t -103.55 98.68 13.21 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.724 178.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.441 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 87.4 Cg_exo -46.13 145.52 5.32 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 122.448 2.099 . . . . 0.0 112.438 -179.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.433 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 2.1 mptt -83.45 143.44 44.53 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.056 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 15.1 Cg_exo -73.55 152.56 48.72 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 123.558 2.839 . . . . 0.0 112.629 -178.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -67.2 147.76 52.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.585 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.8 mtp-105 -147.56 120.05 8.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.156 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -99.06 159.05 15.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.402 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 23.1 ttt -133.41 138.94 46.47 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.006 0.431 . . . . 0.0 111.567 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.716 ' CD1' HD11 ' A' ' 16' ' ' ILE . 95.3 m-85 -152.02 125.41 8.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.214 179.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.7 t -98.98 133.01 43.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.095 0.474 . . . . 0.0 111.314 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.691 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 80.7 m-85 -120.19 152.71 37.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.629 179.664 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.49 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 16.7 m-20 -108.4 -6.62 16.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.371 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -121.64 108.73 13.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.871 0.367 . . . . 0.0 110.749 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.86 -28.62 3.88 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.112 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -76.28 -54.93 6.06 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.205 -179.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 58.9 t -53.42 -47.88 58.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.772 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.411 ' HB3' ' CG ' ' A' ' 91' ' ' PHE . 0.0 OUTLIER -61.4 -35.68 78.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.222 179.473 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 54.5 t0 -64.63 -35.63 81.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.465 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.428 ' O ' ' HB ' ' A' ' 103' ' ' THR . 53.9 m-80 -65.45 -42.93 91.8 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.971 179.228 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.573 HD12 ' CG2' ' A' ' 16' ' ' ILE . 27.4 mm -62.38 -52.15 63.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.573 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.426 ' O ' HD13 ' A' ' 48' ' ' LEU . 6.9 pttp -64.05 -27.87 69.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.657 179.685 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 38.4 mtm -78.84 -40.41 32.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.741 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.451 HG22 ' CD1' ' A' ' 18' ' ' ILE . 0.6 OUTLIER -75.56 -43.52 48.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.016 -179.825 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 1.108 HD21 HD22 ' A' ' 42' ' ' LEU . 3.5 mt -61.43 -33.97 74.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.818 0.342 . . . . 0.0 110.981 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.732 ' HA ' HD12 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -67.85 -26.51 66.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.696 -179.988 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -69.49 -30.1 67.89 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.559 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.152 HD13 HD13 ' A' ' 42' ' ' LEU . 3.9 mt -76.38 -45.37 34.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.244 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.732 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.1 mt -57.87 -61.44 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.63 0 CA-C-O 121.669 0.747 . . . . 0.0 109.516 179.367 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.8 m -51.76 -28.81 16.49 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.284 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 3.9 mtt180 -64.41 -35.35 80.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.524 179.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -92.77 -28.86 16.32 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.781 179.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.707 ' HD3' HG22 ' A' ' 108' ' ' ILE . 2.0 mptp? -70.53 -39.65 73.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.75 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -63.28 -37.99 89.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.852 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.76 -33.39 75.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.018 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 43.8 t0 . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.192 -0.908 . . . . 0.0 111.237 179.907 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 8.1 tp . . . . . 0 N--CA 1.487 1.418 0 CA-C-O 120.795 0.331 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 2.0 m -134.75 162.3 58.53 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.992 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_exo -51.63 -42.59 55.54 Favored 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 122.6 2.2 . . . . 0.0 112.379 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -57.42 -29.26 63.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.971 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -65.74 -40.49 92.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.888 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.432 ' HA ' ' CD1' ' B' ' 53' ' ' TRP . 31.0 mm -70.7 -24.24 24.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.324 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.05 -34.13 77.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.058 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 52' ' ' GLN . . . . . 0.43 ' HA ' ' HB ' ' B' ' 55' ' ' THR . 0.9 OUTLIER -64.33 -29.77 70.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.192 -179.851 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 53' ' ' TRP . . . . . 0.455 ' CD2' ' HD2' ' A' ' 57' ' ' LYS . 28.7 m95 -54.96 -28.87 54.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.977 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 54' ' ' PHE . . . . . 0.444 ' CZ ' ' HG2' ' A' ' 61' ' ' ARG . 65.3 m-85 -115.55 -13.35 11.55 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.444 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.43 ' HB ' ' HA ' ' B' ' 52' ' ' GLN . 0.8 OUTLIER -84.03 -28.25 27.79 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.677 0.275 . . . . 0.0 110.795 -179.914 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -73.63 115.48 13.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.837 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -148.49 164.51 21.41 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.874 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo . . . . . 0 C--O 1.249 1.051 0 C-N-CA 122.621 2.214 . . . . 0.0 112.355 179.923 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo . . . . . 0 N--CA 1.477 0.526 0 CA-C-O 120.886 0.286 . . . . 0.0 111.831 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.0 m -65.67 -29.08 69.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.07 179.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.422 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 66.3 m80 -141.35 34.99 1.67 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.136 0.493 . . . . 0.0 110.963 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.49 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 6.2 p -173.32 116.75 0.27 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.877 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -146.57 117.67 0.97 Allowed Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.391 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.638 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -41.38 108.69 0.1 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.178 0.513 . . . . 0.0 111.673 -179.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.66 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -122.35 153.04 39.52 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.974 -178.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.546 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -100.11 125.53 53.82 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.236 0 CA-C-O 120.956 0.408 . . . . 0.0 110.35 178.881 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.508 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 5.7 t80 -113.1 130.85 56.04 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.134 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 55.4 34.29 22.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.9 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 30.9 mttm 76.28 1.21 3.37 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.322 -179.046 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.518 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.6 t -99.69 154.29 4.27 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.641 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 178.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.546 ' HA ' HG13 ' A' ' 8' ' ' ILE . 90.6 p -95.65 149.2 21.72 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.579 0.704 . . . . 0.0 112.613 -178.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.476 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.42 -179.62 46.53 Favored Glycine 0 N--CA 1.446 -0.648 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.347 -179.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.638 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.71 142.65 19.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 117.608 0.704 . . . . 0.0 110.68 179.367 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.836 HG12 HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -106.77 118.49 54.62 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.764 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 179.48 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -118.28 123.91 46.55 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.334 -178.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.422 ' O ' ' HB3' ' A' ' 3' ' ' HIS . 42.2 mt -96.74 138.46 21.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.995 -179.403 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 65.9 m-20 -131.03 114.2 14.89 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.988 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -91.92 5.93 48.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.169 179.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -78.95 -18.13 54.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.957 0.408 . . . . 0.0 110.313 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.78 145.24 10.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.886 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.424 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.0 t -119.44 115.65 33.96 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.967 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.454 ' HG2' HG23 ' A' ' 41' ' ' VAL . 79.7 Cg_endo -78.06 146.3 80.54 Favored 'Cis proline' 0 C--N 1.348 0.53 0 C-N-CA 123.42 -1.492 . . . . 0.0 112.193 0.132 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -47.63 137.69 8.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.629 179.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -127.3 167.05 16.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.153 0.501 . . . . 0.0 111.701 -179.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.836 HD21 HG12 ' A' ' 16' ' ' ILE . 5.0 tt -121.16 130.58 53.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.8 179.417 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.3 m -116.6 123.93 48.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.117 0.484 . . . . 0.0 111.907 -179.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.49 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 58.5 t90 -100.63 128.93 46.51 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.073 179.311 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 8.5 ttm180 -124.68 116.32 22.18 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.824 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.476 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 28.8 t -45.24 164.13 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.091 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.51 -41.42 65.94 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.498 0.666 . . . . 0.0 109.611 179.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -81.13 -22.08 39.32 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.075 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.29 33.25 10.75 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.447 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -107.33 -21.12 13.05 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.658 0.266 . . . . 0.0 111.489 -179.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.496 ' NZ ' HG21 ' A' ' 12' ' ' VAL . 7.3 mtmt -127.2 134.41 50.13 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.862 0.363 . . . . 0.0 111.176 -179.852 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.4 t -139.13 136.19 42.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.939 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.508 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 85.7 t60 -138.81 146.21 41.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.217 0.532 . . . . 0.0 111.387 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 49.6 m -126.09 139.41 53.41 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.893 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 95.8 t -131.77 140.87 47.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.094 0.474 . . . . 0.0 111.637 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.768 HG13 ' CG2' ' A' ' 44' ' ' THR . 1.4 p -85.35 118.06 31.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 178.022 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 1.029 HD13 HD13 ' A' ' 107' ' ' ILE . 61.2 mt -72.38 -30.23 64.49 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.212 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.448 ' CB ' ' HB2' ' A' ' 24' ' ' PRO . 2.3 t -53.91 -23.66 13.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.682 0.277 . . . . 0.0 111.641 -179.516 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.768 ' CG2' HG13 ' A' ' 41' ' ' VAL . 0.2 OUTLIER -84.56 -25.49 28.66 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.137 -179.855 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.622 HD12 ' HB3' ' A' ' 62' ' ' LEU . 45.6 mm -54.33 101.39 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.129 -179.505 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -95.78 -20.66 18.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.54 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.465 ' HB2' HG13 ' A' ' 63' ' ' ILE . 35.8 mttt -153.39 133.43 13.3 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.009 0.433 . . . . 0.0 111.302 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.725 HD11 ' HB3' ' A' ' 104' ' ' LEU . 54.0 mt -105.81 124.28 49.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.632 179.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -109.66 130.39 55.52 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.467 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.617 ' HB3' ' HE2' ' A' ' 101' ' ' LYS . . . -142.05 142.07 32.83 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.98 -179.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 81.3 p -75.75 137.71 70.09 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.57 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.16 152.95 55.89 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.583 2.189 . . . . 0.0 112.503 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.01 -43.0 99.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.181 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.1 m -58.01 -27.63 63.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.697 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.4 m -82.35 119.99 24.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.795 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -57.2 -18.27 14.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.456 179.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.423 ' HB3' ' CE3' ' B' ' 53' ' ' TRP . 32.0 mmtt -58.46 134.49 56.71 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.045 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.467 ' HE3' ' HB3' ' A' ' 58' ' ' MET . 30.5 mmm -122.15 100.56 7.03 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.48 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -174.81 145.15 0.85 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.008 0.432 . . . . 0.0 111.784 -179.659 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.619 HD11 ' HB2' ' A' ' 101' ' ' LYS . 2.5 tt -126.22 131.46 51.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.107 179.388 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.438 ' HB2' ' CZ ' ' B' ' 54' ' ' PHE . 0.0 OUTLIER -112.79 124.05 51.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.96 0.41 . . . . 0.0 111.959 -179.071 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.622 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.4 OUTLIER -92.91 143.53 26.16 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.973 178.753 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.465 HG13 ' HB2' ' A' ' 47' ' ' LYS . 1.1 mm -118.55 120.47 64.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.263 -179.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -88.79 147.01 19.57 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.068 179.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -59.38 135.35 57.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.9 0.381 . . . . 0.0 111.077 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.487 ' CG2' ' N ' ' A' ' 67' ' ' ASP . 1.8 p -77.88 161.13 4.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.415 0.626 . . . . 0.0 111.563 -179.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.487 ' N ' ' CG2' ' A' ' 66' ' ' VAL . 91.2 m-20 -90.77 77.51 6.26 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.627 179.628 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -63.56 -15.98 59.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.377 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 34.0 m -55.26 -21.98 16.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.808 0.337 . . . . 0.0 111.072 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.6 mmtp -78.81 -68.23 0.67 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.864 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.1 mttp 59.86 92.98 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.988 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.422 ' O ' ' N ' ' A' ' 80' ' ' VAL . 20.0 mtm-85 -93.49 -176.95 4.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.414 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -125.82 153.78 43.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.982 0.42 . . . . 0.0 111.165 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -87.03 168.39 13.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.816 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -58.47 -21.05 50.16 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.4 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -90.99 7.53 39.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.614 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.82 -11.91 68.97 Favored Glycine 0 C--N 1.332 0.339 0 C-N-CA 120.511 -0.852 . . . . 0.0 112.755 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -66.72 175.48 2.37 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.74 0.305 . . . . 0.0 110.829 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -96.66 163.76 12.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.924 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.525 HG12 ' N ' ' A' ' 81' ' ' VAL . 22.1 t -135.72 157.78 39.16 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 CA-C-O 121.519 0.676 . . . . 0.0 111.869 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.525 ' N ' HG12 ' A' ' 80' ' ' VAL . 15.6 t -124.73 97.89 38.06 Favored Pre-proline 0 C--N 1.32 -0.715 0 CA-C-N 114.819 -1.082 . . . . 0.0 108.354 177.596 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -45.05 166.24 0.05 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.253 1.969 . . . . 0.0 112.61 -178.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.52 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 1.1 mtmm -84.53 137.16 39.08 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 120.934 0.397 . . . . 0.0 110.958 -179.752 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.52 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 10.1 Cg_exo -76.23 165.78 28.87 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 123.367 2.711 . . . . 0.0 112.613 -179.119 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -65.5 156.1 33.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.534 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 66.7 mtm180 -148.68 133.25 17.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.82 0.343 . . . . 0.0 111.154 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.413 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 46.6 m-70 -116.31 159.03 22.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.503 179.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 24.3 ttt -125.69 142.1 51.68 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.996 0.427 . . . . 0.0 111.37 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.558 ' CE2' HD11 ' A' ' 16' ' ' ILE . 95.9 m-85 -152.02 125.81 9.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.514 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.3 t -101.61 143.02 32.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.989 0.423 . . . . 0.0 111.18 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.66 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 54.2 m-85 -130.09 172.48 11.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.671 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 74.8 m-20 -132.36 23.38 4.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.184 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -154.08 116.43 4.34 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.832 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 9.0 mtt85 -57.73 -31.46 66.47 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.001 0.429 . . . . 0.0 110.751 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.03 -54.99 18.99 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.724 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 61.8 t -61.56 -37.55 78.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.186 179.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.507 ' HG3' ' CG ' ' A' ' 91' ' ' PHE . 1.4 ttp -69.3 -33.19 72.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.392 179.352 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.467 ' O ' ' HB3' ' A' ' 102' ' ' MET . 22.0 t70 -72.41 -25.13 61.37 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.146 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -80.98 -51.59 8.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.977 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 16.8 mm -53.83 -52.07 38.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.027 0.442 . . . . 0.0 110.782 179.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.619 ' HB2' HD11 ' A' ' 60' ' ' LEU . 0.6 OUTLIER -60.59 -27.86 68.04 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.93 179.726 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.467 ' HB3' ' O ' ' A' ' 98' ' ' ASP . 0.8 OUTLIER -78.78 -43.96 24.3 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.902 -179.972 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.84 -44.31 70.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.087 -179.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.78 ' CD2' HD22 ' A' ' 42' ' ' LEU . 16.2 mt -58.33 -38.96 78.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.832 0.349 . . . . 0.0 110.971 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.77 ' HA ' HD12 ' A' ' 108' ' ' ILE . 2.0 mt-30 -63.09 -28.72 70.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.961 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -68.49 -37.21 79.9 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.819 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.029 HD13 HD13 ' A' ' 42' ' ' LEU . 3.4 mt -68.68 -44.55 82.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.335 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.77 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.1 mt -59.96 -61.02 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.618 0 CA-C-O 121.7 0.762 . . . . 0.0 109.319 179.024 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.5 t -50.6 -29.27 10.46 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.392 -1.276 . . . . 0.0 110.903 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 51.1 mtt180 -67.88 -33.81 75.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.079 0.466 . . . . 0.0 110.52 179.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -105.47 -0.97 25.45 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.911 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.93 -33.15 7.01 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.839 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -61.79 -36.6 81.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.728 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.12 -33.78 75.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.049 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.846 -179.987 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . 0.666 HD21 ' OD2' ' B' ' 49' ' ' ASP . 10.0 tp . . . . . 0 N--CA 1.487 1.413 0 CA-C-O 120.81 0.338 . . . . 0.0 111.097 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.4 m -119.33 163.15 28.46 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.834 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.69 -36.34 92.22 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.604 2.203 . . . . 0.0 112.257 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 50.9 p30 -59.63 -16.83 28.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.037 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . 0.666 ' OD2' HD21 ' B' ' 45' ' ' LEU . 2.5 t70 -77.77 -40.27 41.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.267 -179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 32.8 mm -71.65 -29.63 35.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.731 -179.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -77.82 -26.24 49.41 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.131 -179.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -59.17 -30.17 67.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.793 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 53' ' ' TRP . . . . . 0.423 ' CE3' ' HB3' ' A' ' 57' ' ' LYS . 14.0 m95 -62.92 -35.28 79.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.871 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 54' ' ' PHE . . . . . 0.438 ' CZ ' ' HB2' ' A' ' 61' ' ' ARG . 82.6 m-85 -99.18 -0.29 41.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.42 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.71 -32.58 74.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.75 0.31 . . . . 0.0 110.855 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -60.03 135.13 57.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.9 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -149.6 85.6 5.67 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.934 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo . . . . . 0 C--O 1.249 1.067 0 C-N-CA 122.622 2.214 . . . . 0.0 112.286 -179.965 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo . . . . . 0 N--CA 1.475 0.424 0 CA-C-O 120.844 0.268 . . . . 0.0 111.787 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.5 t 58.4 107.09 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.027 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 76.2 m80 63.59 33.33 13.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.111 0.482 . . . . 0.0 111.14 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.584 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 64.2 p 178.25 171.83 0.71 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.841 179.139 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 155.78 119.15 0.63 Allowed Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.21 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.628 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -47.07 108.73 0.16 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.101 0.476 . . . . 0.0 111.404 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.814 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -123.7 153.18 41.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.81 -178.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.562 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.9 OUTLIER -99.72 124.36 53.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.976 0.417 . . . . 0.0 110.419 179.021 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.505 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 19.7 t80 -113.19 129.83 56.4 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.085 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.421 ' HG3' ' CD2' ' A' ' 9' ' ' PHE . 83.8 mt-10 57.08 34.46 24.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.894 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 29.2 mmtt 75.77 1.93 3.63 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.24 -179.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.522 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.9 t -100.78 154.39 4.58 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.634 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.562 ' HA ' HG13 ' A' ' 8' ' ' ILE . 79.9 p -96.67 148.7 22.6 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-O 121.557 0.694 . . . . 0.0 112.517 -178.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.484 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.15 -179.74 46.22 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-N 114.649 -1.16 . . . . 0.0 110.404 -179.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.628 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.41 141.55 21.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 117.611 0.706 . . . . 0.0 110.602 179.378 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.683 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.75 118.57 54.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 179.53 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.485 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -119.8 139.83 51.72 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.19 -178.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.513 ' CG1' HD12 ' A' ' 27' ' ' LEU . 94.1 mt -116.51 140.04 40.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.501 -178.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -125.56 111.37 14.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.7 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -94.21 7.88 43.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.244 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -80.43 -17.91 50.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.814 0.34 . . . . 0.0 110.346 179.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.49 ' CG2' ' N ' ' A' ' 23' ' ' SER . 0.6 OUTLIER -106.93 159.27 6.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.201 0.524 . . . . 0.0 111.227 -179.995 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.49 ' N ' ' CG2' ' A' ' 22' ' ' VAL . 7.1 m -131.27 121.54 18.61 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.811 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.431 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 5.7 Cg_exo -76.51 137.58 49.85 Favored 'Cis proline' 0 C--N 1.348 0.504 0 C-N-CA 123.529 -1.446 . . . . 0.0 111.873 -0.063 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.584 ' O ' HD22 ' A' ' 42' ' ' LEU . . . -44.74 140.8 2.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.679 179.614 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -127.36 158.48 37.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.324 0.583 . . . . 0.0 112.046 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.717 ' HB2' HD11 ' A' ' 42' ' ' LEU . 4.2 tt -121.39 129.9 53.3 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.127 179.064 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.0 m -121.05 125.95 48.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.255 0.55 . . . . 0.0 112.334 -178.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.485 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 63.6 t90 -100.6 128.39 46.67 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.647 178.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 55.2 ttt-85 -125.59 118.16 25.12 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.863 0.363 . . . . 0.0 111.02 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.484 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 33.3 m -45.63 166.58 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.92 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.02 -41.68 67.26 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.47 0.652 . . . . 0.0 109.754 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -100.37 -9.84 21.83 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.852 -1.067 . . . . 0.0 111.209 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 91.73 26.86 18.68 Favored Glycine 0 C--N 1.331 0.299 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.391 -179.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -71.61 -24.02 61.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.742 0.306 . . . . 0.0 111.673 -179.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.51 153.87 19.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.08 0.467 . . . . 0.0 111.489 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.8 t -139.04 132.81 39.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.699 179.593 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.505 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 43.3 t60 -133.76 145.9 50.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.195 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.46 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 52.2 m -129.04 140.18 51.72 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.303 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 90.9 t -134.56 141.62 42.87 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.197 0 CA-C-O 121.152 0.501 . . . . 0.0 111.982 179.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.73 ' HB ' HG23 ' A' ' 44' ' ' THR . 0.0 OUTLIER -88.36 117.43 31.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.719 177.995 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.767 ' H ' HD22 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -68.3 -19.87 64.72 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 120.784 0.326 . . . . 0.0 110.502 179.464 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 86.0 p -65.03 -28.28 69.38 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.07 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.73 HG23 ' HB ' ' A' ' 41' ' ' VAL . 0.1 OUTLIER -86.71 -26.5 24.21 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.715 179.725 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.884 HD12 ' HB3' ' A' ' 62' ' ' LEU . 45.9 mm -57.24 91.31 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.036 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -60.83 -30.58 70.19 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.035 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.622 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 35.4 mttt -152.36 157.44 41.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.927 0.394 . . . . 0.0 111.21 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.61 HD23 ' HG3' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -131.34 126.03 34.23 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.934 179.456 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -122.24 141.19 51.75 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.01 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.418 ' HB2' HD11 ' A' ' 60' ' ' LEU . . . -136.99 147.86 46.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.046 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.637 HG23 ' O ' ' A' ' 59' ' ' MET . 20.1 p -75.82 124.02 88.48 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.743 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.53 160.62 49.08 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.378 2.052 . . . . 0.0 112.408 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.675 ' HB2' ' HE ' ' A' ' 94' ' ' ARG . . . -58.68 -35.22 72.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.081 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.6 t -58.49 -25.84 62.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.005 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 32.7 t -98.57 115.01 27.68 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.822 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -58.26 -18.41 26.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.693 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.441 ' HE3' ' CG ' ' B' ' 53' ' ' TRP . 4.8 mtmm -71.45 97.37 1.63 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.985 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.501 ' HE2' ' HA ' ' A' ' 92' ' ' ASN . 12.0 mmm -82.1 108.27 15.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.765 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.637 ' O ' HG23 ' A' ' 51' ' ' THR . 1.3 tmm? -176.52 145.6 0.57 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.108 0.48 . . . . 0.0 111.742 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.493 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -115.69 159.99 20.65 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.938 179.354 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.441 ' HB2' ' CZ ' ' B' ' 54' ' ' PHE . 7.3 tpt180 -145.86 127.72 15.4 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -179.632 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.884 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.2 OUTLIER -105.56 144.17 32.69 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.316 179.126 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.622 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 2.4 mm -103.65 114.32 42.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.744 0.306 . . . . 0.0 111.416 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -79.32 129.19 8.99 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.106 179.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 20.6 mttt -52.03 148.14 6.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.939 0.4 . . . . 0.0 111.197 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.794 HG22 ' H ' ' A' ' 67' ' ' ASP . 2.1 p -108.76 -162.34 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.876 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.794 ' H ' HG22 ' A' ' 66' ' ' VAL . 5.7 t70 -156.7 71.49 0.69 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.97 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.525 ' CG ' HG13 ' A' ' 81' ' ' VAL . 42.0 mp0 -55.67 -21.56 18.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.466 -179.263 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.1 t -56.83 -19.68 18.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.084 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 32.3 mmtt -72.45 -47.67 47.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.978 0.418 . . . . 0.0 110.89 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.2 mmtt 62.85 94.7 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.923 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 15.0 mtt-85 -99.51 143.86 29.27 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.944 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.8 mmtp -87.48 145.66 26.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.005 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.495 ' HB3' HG11 ' A' ' 80' ' ' VAL . 43.6 p30 -97.44 177.6 5.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.107 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -60.99 -19.36 61.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.302 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -88.38 11.41 16.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.516 -179.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 68.67 17.62 71.24 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.708 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -117.09 146.24 43.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.94 0.4 . . . . 0.0 110.876 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -70.71 144.28 51.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.97 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.495 HG11 ' HB3' ' A' ' 74' ' ' ASP . 2.8 m -140.51 158.76 24.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.195 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.525 HG13 ' CG ' ' A' ' 68' ' ' GLU . 18.6 t -83.31 110.37 23.62 Favored Pre-proline 0 C--N 1.327 -0.378 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.429 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.44 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 71.7 Cg_exo -48.58 145.9 11.66 Favored 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 122.094 1.862 . . . . 0.0 112.668 -178.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.486 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 29.0 mttm -74.66 102.93 0.74 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.135 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.486 ' HD2' ' HA ' ' A' ' 83' ' ' LYS . 1.0 OUTLIER -40.17 149.38 0.14 Allowed 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 123.534 2.823 . . . . 0.0 112.642 179.275 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.36 155.15 36.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.771 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 55.6 mtt85 -153.49 119.83 5.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.68 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 84.4 m-70 -93.5 154.49 17.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.643 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.532 ' HE3' HG23 ' B' ' 50' ' ' ILE . 24.4 ttt -130.88 118.97 21.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.905 0.383 . . . . 0.0 111.484 -179.639 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.599 ' CE2' HD11 ' A' ' 16' ' ' ILE . 94.4 m-85 -127.73 125.47 40.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.215 179.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.98 131.44 44.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.995 0.426 . . . . 0.0 111.211 -179.538 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.814 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 12.1 m-85 -121.08 161.44 21.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.611 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.501 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 75.1 m-20 -124.63 29.34 6.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.009 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 74.8 m-80 -156.6 112.32 2.94 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.795 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.675 ' HE ' ' HB2' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -52.71 -28.17 20.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.05 0.453 . . . . 0.0 111.044 -179.971 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.435 HG22 ' N ' ' A' ' 96' ' ' VAL . 0.9 OUTLIER -77.43 -54.91 5.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.853 179.877 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.435 ' N ' HG22 ' A' ' 95' ' ' THR . 40.3 t -56.31 -44.76 80.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.87 -179.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.404 ' CG ' ' HA ' ' A' ' 94' ' ' ARG . 0.2 OUTLIER -65.84 -35.97 82.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.115 179.261 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -66.64 -33.01 74.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.562 179.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.437 ' O ' ' HB ' ' A' ' 103' ' ' THR . 76.6 m-20 -63.49 -35.43 80.41 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.874 179.309 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.54 HD12 ' CG2' ' A' ' 16' ' ' ILE . 21.5 mm -71.07 -51.99 30.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.577 179.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.593 ' HB2' HD11 ' A' ' 48' ' ' LEU . 11.3 pttp -64.53 -27.23 68.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.614 179.663 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 44.1 mtm -78.21 -38.36 43.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.521 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.458 HG21 HD12 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -78.61 -38.11 40.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.611 179.728 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.643 HD21 HD12 ' A' ' 42' ' ' LEU . 12.0 mt -63.54 -40.36 96.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.592 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.827 ' HA ' HD12 ' A' ' 108' ' ' ILE . 12.1 mt-30 -62.99 -27.4 69.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.979 0.419 . . . . 0.0 111.04 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -70.41 -38.65 74.66 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.151 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.678 HD13 HD23 ' A' ' 42' ' ' LEU . 60.8 mt -68.81 -46.68 79.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.543 -179.654 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.827 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.6 mt -56.61 -60.17 2.22 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.621 0 CA-C-O 121.84 0.828 . . . . 0.0 109.507 179.187 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.7 m -48.78 -29.0 4.05 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.107 -1.406 . . . . 0.0 111.389 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 50.7 mtt-85 -70.82 -32.31 69.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.046 0.45 . . . . 0.0 110.809 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -95.6 -30.85 13.57 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.018 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.802 ' HD3' HG22 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -68.15 -36.87 80.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.577 179.709 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -62.28 -37.99 87.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.924 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.9 -34.55 78.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.06 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 22.8 t70 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.896 -179.945 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . 0.536 HD23 ' O ' ' B' ' 45' ' ' LEU . 7.2 tt . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.817 0.341 . . . . 0.0 111.189 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 17.0 p -121.19 164.03 26.45 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.821 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_exo -51.34 -43.25 50.54 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.575 2.184 . . . . 0.0 112.383 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -59.28 -29.05 67.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.815 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -63.86 -45.73 88.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.806 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.532 HG23 ' HE3' ' A' ' 88' ' ' MET . 34.0 mm -67.51 -27.87 40.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.244 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -68.07 -33.31 74.31 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.843 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 52' ' ' GLN . . . . . 0.405 ' HA ' ' HB ' ' B' ' 55' ' ' THR . 0.0 OUTLIER -62.7 -29.95 71.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.09 179.929 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 53' ' ' TRP . . . . . 0.445 ' CE3' ' CE ' ' A' ' 59' ' ' MET . 11.4 m0 -57.72 -29.61 64.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.193 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 54' ' ' PHE . . . . . 0.441 ' CZ ' ' HB2' ' A' ' 61' ' ' ARG . 98.2 m-85 -98.47 -15.63 19.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.554 -179.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.405 ' HB ' ' HA ' ' B' ' 52' ' ' GLN . 0.8 OUTLIER -75.41 -30.57 60.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.818 0.342 . . . . 0.0 110.857 -180.0 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 21.3 pt-20 -61.01 139.01 58.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.924 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 62.57 147.86 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.869 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo . . . . . 0 C--O 1.249 1.052 0 C-N-CA 122.511 2.141 . . . . 0.0 112.341 179.934 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo . . . . . 0 N--CA 1.476 0.457 0 CA-C-O 120.92 0.3 . . . . 0.0 111.799 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.3 t -160.58 119.52 2.64 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.727 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.408 ' HB3' ' O ' ' A' ' 18' ' ' ILE . 59.3 m80 65.08 32.94 9.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.077 179.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.521 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 60.4 p -175.01 164.58 3.39 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.767 179.239 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.414 ' CA ' HG13 ' A' ' 96' ' ' VAL . . . 160.87 117.93 0.46 Allowed Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.383 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.631 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -47.06 110.46 0.3 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.085 0.469 . . . . 0.0 111.459 -179.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.761 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -125.61 150.78 47.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.632 -179.064 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.568 HG13 ' HA ' ' A' ' 13' ' ' SER . 0.8 OUTLIER -99.51 124.99 53.19 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-O 121.014 0.435 . . . . 0.0 110.443 179.332 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.515 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 7.1 t80 -112.93 130.73 56.01 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.163 179.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 55.88 34.28 23.25 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.944 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 78.7 mttt 76.11 1.5 3.45 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.274 -179.09 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.53 ' O ' HG23 ' A' ' 8' ' ' ILE . 40.6 t -100.16 154.62 4.36 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.586 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.013 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.568 ' HA ' HG13 ' A' ' 8' ' ' ILE . 89.2 p -96.47 149.15 22.05 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.638 0.733 . . . . 0.0 112.785 -178.487 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.46 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . 175.23 -179.77 46.27 Favored Glycine 0 N--CA 1.445 -0.705 0 CA-C-N 114.436 -1.256 . . . . 0.0 110.298 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.631 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.57 143.39 17.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 117.73 0.765 . . . . 0.0 110.438 179.352 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.887 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.75 118.3 54.22 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.682 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.625 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.486 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -121.64 133.82 54.98 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.345 -178.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.622 HG23 HD11 ' A' ' 42' ' ' LEU . 90.6 mt -106.33 140.1 25.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.184 -179.028 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -131.99 111.4 11.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.904 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -89.77 6.26 42.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.312 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -79.02 -18.05 54.25 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.906 0.384 . . . . 0.0 110.398 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -98.98 144.25 12.11 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.09 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.433 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.9 t -116.47 116.32 39.2 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.755 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.447 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 1.8 Cg_endo -80.01 143.8 67.41 Favored 'Cis proline' 0 C--N 1.349 0.562 0 C-N-CA 123.819 -1.326 . . . . 0.0 111.883 -0.05 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.56 140.68 4.19 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.884 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -134.25 167.21 21.12 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.251 0.548 . . . . 0.0 111.746 -179.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.887 HD21 HG12 ' A' ' 16' ' ' ILE . 6.0 tt -121.18 128.17 52.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.674 179.572 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.3 m -115.72 128.55 55.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.174 0.511 . . . . 0.0 112.339 -178.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.48 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 57.2 t90 -100.53 130.1 46.56 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.461 -0.791 . . . . 0.0 109.714 178.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 17.0 ttt180 -124.45 115.72 21.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.831 0.348 . . . . 0.0 110.947 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.46 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 3.8 p -45.45 166.38 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.109 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.65 -42.0 59.32 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 121.416 0.627 . . . . 0.0 109.792 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 48.7 p30 -81.94 -19.44 40.7 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.313 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.89 33.88 11.89 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.271 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -108.54 -21.37 12.75 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.731 0.271 . . . . 0.0 111.731 -179.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.486 ' HE2' HG21 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -128.27 134.52 48.96 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.885 0.374 . . . . 0.0 111.103 -179.793 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 12.2 p -139.3 137.79 40.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.063 179.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.515 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 56.5 t60 -136.97 146.05 44.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.144 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 46.9 m -127.82 134.03 49.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.172 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 97.7 t -124.33 140.8 46.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.367 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.597 HG22 HG23 ' A' ' 44' ' ' THR . 2.0 p -85.3 117.61 30.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.12 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 1.021 HD13 HD13 ' A' ' 107' ' ' ILE . 83.5 mt -75.38 -29.67 59.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.982 -178.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.447 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 10.9 t -55.49 -22.16 19.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.867 -179.2 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.597 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -95.49 -22.14 17.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.719 0.295 . . . . 0.0 111.195 -179.896 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.796 HD12 ' HB3' ' A' ' 62' ' ' LEU . 36.7 mm -57.11 89.3 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.886 -179.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -74.32 -27.88 60.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.506 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.724 ' HB2' ' CG1' ' A' ' 63' ' ' ILE . 28.6 mtpt -141.13 146.04 36.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.132 0.492 . . . . 0.0 111.769 -179.289 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.694 HD23 ' HG2' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -132.33 124.95 29.8 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.607 179.301 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.664 ' O ' HD23 ' A' ' 60' ' ' LEU . 94.4 mt-30 -127.28 145.05 50.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.943 0.401 . . . . 0.0 111.552 -178.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -133.2 156.98 46.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.836 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 46.5 p -75.74 133.52 73.26 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.528 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.7 154.98 51.24 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.631 2.221 . . . . 0.0 112.557 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.33 -42.98 99.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.155 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.4 m -58.34 -27.53 64.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.09 0.472 . . . . 0.0 110.737 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 29.4 t -81.99 119.85 24.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.811 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -56.84 -18.44 13.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.438 179.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.422 ' HD2' ' CE3' ' B' ' 53' ' ' TRP . 24.6 mmtm -61.01 149.38 36.99 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.944 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.404 ' CE ' ' N ' ' A' ' 93' ' ' ASN . 15.6 mmm -133.78 79.98 1.85 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.672 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.423 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.6 OUTLIER -147.62 169.11 20.34 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.06 0.457 . . . . 0.0 112.037 -179.541 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.675 HD21 ' CD1' ' A' ' 48' ' ' LEU . 0.3 OUTLIER -144.69 131.13 19.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.872 179.47 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.469 ' HD2' HD13 ' A' ' 63' ' ' ILE . 4.0 tmm_? -113.48 132.34 55.7 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.043 0.449 . . . . 0.0 112.211 -178.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.796 ' HB3' HD12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -110.48 140.64 44.55 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.229 179.246 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.724 ' CG1' ' HB2' ' A' ' 47' ' ' LYS . 1.2 mm -111.82 127.33 69.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.772 0.32 . . . . 0.0 111.328 179.72 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.56 129.66 9.98 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.217 179.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.6 mttt -44.35 145.63 0.79 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.833 0.349 . . . . 0.0 111.413 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.715 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.2 p -117.73 -162.05 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.815 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.715 ' H ' HG22 ' A' ' 66' ' ' VAL . 7.3 t0 -178.81 50.44 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.503 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -57.59 -22.5 45.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.334 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 23.7 t -62.1 -16.11 50.04 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.944 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.1 mttt -69.7 -39.95 76.6 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.094 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.8 mtmt 60.43 90.96 0.06 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.813 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 74.3 mmt-85 -94.4 143.88 26.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.022 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 45.4 mmtt -88.14 145.86 25.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.905 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -94.49 173.21 7.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.894 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -60.33 -20.03 57.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.23 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -86.64 4.79 38.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.426 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.3 15.22 81.73 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.606 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -111.72 144.69 40.6 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.812 0.339 . . . . 0.0 110.99 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -71.76 148.01 46.75 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.044 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.449 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 1.5 m -131.01 158.82 43.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.95 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 38.9 t -103.64 98.58 13.18 Favored Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.749 178.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.449 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 86.8 Cg_exo -46.2 162.61 0.12 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.411 2.074 . . . . 0.0 112.419 -179.106 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.507 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -117.8 143.79 33.19 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.745 179.928 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.507 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 15.2 Cg_exo -73.47 148.29 42.55 Favored 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 123.453 2.768 . . . . 0.0 112.695 -179.087 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -76.61 147.88 37.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.759 179.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.8 mtp180 -150.93 121.84 7.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.959 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -110.17 146.99 34.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.627 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -129.61 135.73 48.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.31 -179.723 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.683 ' CE1' HD11 ' A' ' 16' ' ' ILE . 97.7 m-85 -135.6 153.98 51.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.811 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.423 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.4 OUTLIER -126.55 123.89 38.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.912 0.387 . . . . 0.0 110.871 -179.973 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.761 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 2.2 m-85 -112.87 172.74 6.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.808 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.4 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 23.6 p30 -124.69 26.35 7.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.218 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.404 ' N ' ' CE ' ' A' ' 58' ' ' MET . 80.4 m-20 -158.07 122.02 4.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.97 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -56.91 -35.18 68.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.191 0.519 . . . . 0.0 110.693 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.34 -50.26 60.71 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.014 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.414 HG13 ' CA ' ' A' ' 5' ' ' GLY . 52.4 t -59.48 -39.5 79.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.535 179.567 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.559 ' HG2' HD12 ' A' ' 60' ' ' LEU . 2.0 mtp -65.84 -36.58 83.86 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.525 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -68.96 -34.52 75.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.837 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.43 ' O ' ' HB ' ' A' ' 103' ' ' THR . 62.9 m-20 -61.5 -42.65 99.12 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.255 179.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.504 HD12 ' CG2' ' A' ' 16' ' ' ILE . 23.9 mm -66.49 -51.44 57.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.543 179.422 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.552 ' HB2' HD11 ' A' ' 48' ' ' LEU . 0.3 OUTLIER -65.52 -27.2 68.29 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.646 179.626 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.1 mmm -78.19 -37.5 45.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.445 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.43 ' HB ' ' O ' ' A' ' 99' ' ' ASN . 0.6 OUTLIER -80.69 -36.8 31.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.666 179.761 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.683 ' HA ' HD12 ' A' ' 107' ' ' ILE . 13.0 mt -63.64 -41.48 98.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.758 179.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.76 ' HA ' HD12 ' A' ' 108' ' ' ILE . 1.4 mt-30 -62.42 -28.46 69.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.022 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -69.53 -32.76 71.78 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.035 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.021 HD13 HD13 ' A' ' 42' ' ' LEU . 5.6 mt -75.11 -45.2 42.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.38 -179.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.76 HD12 ' HA ' ' A' ' 105' ' ' GLN . 1.9 mt -58.32 -61.13 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.556 0 CA-C-O 121.769 0.795 . . . . 0.0 109.428 179.282 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.4 m -50.72 -28.72 9.69 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.376 -1.284 . . . . 0.0 110.637 179.24 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.3 ttm180 -70.11 -48.31 58.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.263 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.417 ' CE2' ' HA ' ' A' ' 43' ' ' SER . 26.6 m-85 -74.44 -29.09 61.34 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.415 179.66 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 2.2 mttt -63.35 -45.39 91.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.587 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -58.66 -36.6 74.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.937 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.63 -33.06 74.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.137 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 23.3 t70 . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.899 179.98 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 25.0 tp . . . . . 0 N--CA 1.486 1.332 0 CA-C-O 120.908 0.385 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 3.2 m -128.91 164.8 36.39 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.948 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -52.73 -33.74 61.28 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.576 2.184 . . . . 0.0 112.343 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -57.15 -22.75 42.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.039 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -80.82 -36.1 32.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.264 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 42.1 mm -81.54 -29.01 10.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.843 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 19.9 pt-20 -67.0 -28.88 68.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.979 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -60.35 -36.77 78.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.664 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 53' ' ' TRP . . . . . 0.422 ' CE3' ' HD2' ' A' ' 57' ' ' LYS . 44.7 m95 -58.93 -30.74 68.09 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.823 -179.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 54' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -99.81 -0.88 38.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.253 179.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -105.71 -40.58 5.7 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.85 0.357 . . . . 0.0 110.915 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -59.61 141.14 55.61 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.027 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -142.13 162.32 46.18 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.886 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo . . . . . 0 C--O 1.25 1.082 0 C-N-CA 122.544 2.163 . . . . 0.0 112.322 -179.997 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo . . . . . 0 N--CA 1.476 0.443 0 CA-C-O 120.871 0.28 . . . . 0.0 111.783 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.574 ' HG ' ' CE1' ' A' ' 3' ' ' HIS . 39.9 t -177.87 -72.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.912 -179.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.574 ' CE1' ' HG ' ' A' ' 2' ' ' SER . 48.3 m80 -115.05 34.52 4.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.196 0.522 . . . . 0.0 110.93 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.496 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 19.2 p -171.29 141.91 1.65 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.59 179.154 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -172.54 118.19 0.7 Allowed Glycine 0 N--CA 1.446 -0.683 0 C-N-CA 120.531 -0.842 . . . . 0.0 112.429 179.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.642 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -45.68 103.25 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.122 0.487 . . . . 0.0 111.375 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.807 ' HB2' ' CE2' ' A' ' 91' ' ' PHE . . . -119.4 153.78 34.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.813 -178.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.649 HG23 ' O ' ' A' ' 12' ' ' VAL . 1.0 OUTLIER -99.98 126.59 53.43 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.255 0 CA-C-O 121.076 0.465 . . . . 0.0 110.372 178.968 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.505 ' CE2' ' CG ' ' A' ' 38' ' ' HIS . 22.2 t80 -114.68 128.12 56.14 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.03 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 82.8 mt-10 58.02 37.87 26.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.684 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 10' ' ' GLU . 2.3 mmtt 72.01 2.94 4.5 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.567 -179.153 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.649 ' O ' HG23 ' A' ' 8' ' ' ILE . 39.6 t -101.83 155.19 4.84 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.582 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 178.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.554 ' HA ' HG13 ' A' ' 8' ' ' ILE . 96.4 p -96.57 149.07 22.18 Favored 'General case' 0 C--N 1.313 -1.022 0 CA-C-O 121.594 0.712 . . . . 0.0 112.617 -178.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.464 ' O ' ' O ' ' A' ' 7' ' ' ALA . . . 175.64 -179.59 46.73 Favored Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 114.603 -1.18 . . . . 0.0 110.347 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.642 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -106.62 141.97 20.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 117.732 0.766 . . . . 0.0 110.53 179.413 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.851 HG12 HD21 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -106.68 118.38 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 179.551 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.411 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -119.64 135.0 54.99 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.353 -178.639 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.476 ' CG1' HD12 ' A' ' 27' ' ' LEU . 69.6 mt -107.16 140.12 26.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.597 -0.728 . . . . 0.0 111.171 -179.01 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 70.0 m-20 -132.08 113.25 13.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.925 -179.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -90.83 6.11 45.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.169 179.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 86.3 m-20 -79.48 -17.68 53.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.004 0.431 . . . . 0.0 110.478 179.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.68 143.77 13.15 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.985 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.436 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.8 t -116.94 116.16 38.21 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.867 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.442 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 2.0 Cg_endo -79.82 144.0 68.92 Favored 'Cis proline' 0 C--N 1.348 0.529 0 C-N-CA 123.782 -1.341 . . . . 0.0 111.954 0.049 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -45.68 140.68 3.27 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.014 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 68.5 mt-10 -133.62 167.11 21.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.247 0.546 . . . . 0.0 111.654 -179.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.851 HD21 HG12 ' A' ' 16' ' ' ILE . 4.3 tt -121.18 131.81 54.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.713 179.385 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.4 m -118.32 126.98 53.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.072 0.463 . . . . 0.0 112.093 -178.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.495 ' CZ3' ' HB3' ' A' ' 9' ' ' PHE . 60.0 t90 -100.52 130.2 46.56 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.974 179.13 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 8.3 ttt85 -125.28 115.8 20.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.799 0.333 . . . . 0.0 110.912 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.464 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 29.5 t -45.49 166.54 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.142 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.07 -42.08 60.74 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.38 0.61 . . . . 0.0 109.663 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 89.7 m-20 -80.07 -22.72 41.94 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.126 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 88.57 32.96 10.67 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.469 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -108.31 -19.26 13.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.612 0.244 . . . . 0.0 111.471 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.468 ' HE2' HG21 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -127.96 134.95 49.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.791 0.329 . . . . 0.0 111.085 -179.867 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 11.8 p -138.98 139.09 41.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.11 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.505 ' CG ' ' CE2' ' A' ' 9' ' ' PHE . 65.9 t60 -135.82 146.14 47.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.124 0.488 . . . . 0.0 111.253 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 42.0 m -127.52 135.13 49.93 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.846 179.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 99.4 t -130.77 140.82 47.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.012 0.434 . . . . 0.0 111.601 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.654 HG22 HG23 ' A' ' 44' ' ' THR . 1.4 p -84.98 117.8 30.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 178.121 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 1.064 HD22 HD21 ' A' ' 104' ' ' LEU . 45.3 mt -75.44 -30.14 59.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.969 -178.622 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.442 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 11.7 t -55.27 -21.7 15.47 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.654 HG23 HG22 ' A' ' 41' ' ' VAL . 0.1 OUTLIER -89.37 -22.97 22.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.795 0.331 . . . . 0.0 111.213 -179.7 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.51 HG12 ' HA ' ' A' ' 42' ' ' LEU . 48.3 mm -48.41 106.49 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.953 0.406 . . . . 0.0 111.206 -179.618 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -99.46 -20.09 16.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.404 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.442 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 51.2 mttp -154.53 133.01 11.99 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.961 0.41 . . . . 0.0 111.419 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.723 HD11 ' HB3' ' A' ' 104' ' ' LEU . 87.4 mt -107.7 124.36 49.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.664 179.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.492 ' O ' HD23 ' A' ' 60' ' ' LEU . 1.7 tt0 -113.78 134.95 54.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.633 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.608 ' HB1' ' HE1' ' A' ' 97' ' ' MET . . . -142.34 144.99 33.45 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.882 0.372 . . . . 0.0 111.19 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.471 HG22 ' HE2' ' A' ' 57' ' ' LYS . 72.9 p -75.87 129.99 79.72 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.765 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.5 154.31 74.78 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.538 2.159 . . . . 0.0 112.371 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.95 -34.53 74.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.125 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.1 m -59.08 -27.63 65.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.008 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 71.4 m -82.64 120.29 25.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.965 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -58.5 -17.74 23.56 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.525 179.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.471 ' HE2' HG22 ' A' ' 51' ' ' THR . 0.0 OUTLIER -84.61 148.2 26.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.184 -179.852 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.409 ' HE2' ' HB3' ' A' ' 58' ' ' MET . 17.5 mmm -119.45 128.35 53.92 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.683 -179.272 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.626 ' HE2' ' CE3' ' B' ' 53' ' ' TRP . 0.6 OUTLIER -179.88 165.25 1.24 Allowed 'General case' 0 N--CA 1.462 0.136 0 CA-C-O 121.251 0.548 . . . . 0.0 112.331 179.771 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.887 HD11 ' HB3' ' A' ' 101' ' ' LYS . 1.2 tt -148.48 137.3 21.6 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.305 -0.862 . . . . 0.0 109.776 179.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.433 ' HB2' ' CZ ' ' B' ' 54' ' ' PHE . 0.0 OUTLIER -123.35 126.72 47.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.985 0.421 . . . . 0.0 112.008 -179.186 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.463 HD11 HD22 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -99.74 139.65 35.08 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.015 179.038 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.463 HD13 ' HG2' ' A' ' 86' ' ' ARG . 1.0 OUTLIER -118.67 127.89 75.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.164 -179.761 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -95.78 156.79 21.55 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.237 179.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.4 mttp -58.3 157.9 7.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.81 0.338 . . . . 0.0 111.0 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.716 HG22 ' H ' ' A' ' 67' ' ' ASP . 1.2 p -121.86 -162.1 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.966 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.716 ' H ' HG22 ' A' ' 66' ' ' VAL . 54.1 t0 -172.04 61.88 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.278 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.426 ' HB3' HG23 ' A' ' 81' ' ' VAL . 95.1 mt-10 -58.23 -20.79 44.59 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.245 -179.627 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 37.9 m -57.7 -19.08 24.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.087 179.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -61.68 -47.08 86.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.988 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp 62.64 95.31 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.819 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 42.9 mmt180 -103.18 165.44 11.02 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.816 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -125.55 145.3 50.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.979 0.419 . . . . 0.0 111.103 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -85.22 173.01 10.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.872 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.75 -17.76 61.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.291 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -87.65 6.99 31.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.45 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 81.73 -1.35 86.43 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.596 -0.812 . . . . 0.0 112.751 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -84.0 159.49 21.21 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.732 0.301 . . . . 0.0 110.765 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -95.95 147.6 23.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.864 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.427 ' CG2' ' N ' ' A' ' 81' ' ' VAL . 0.2 OUTLIER -140.56 152.66 21.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.597 0.713 . . . . 0.0 111.255 -179.997 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.547 HG13 ' O ' ' A' ' 81' ' ' VAL . 5.7 p -103.24 100.1 16.74 Favored Pre-proline 0 C--N 1.32 -0.708 0 CA-C-N 114.487 -1.233 . . . . 0.0 110.634 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -46.8 145.27 6.99 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.409 2.073 . . . . 0.0 112.509 -179.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -91.42 151.01 42.28 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.047 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.468 ' HA ' HG23 ' A' ' 66' ' ' VAL . 17.0 Cg_exo -72.49 161.09 45.14 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 123.466 2.777 . . . . 0.0 112.716 -178.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -65.36 138.1 57.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.749 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.463 ' HG2' HD13 ' A' ' 63' ' ' ILE . 6.2 mtp-105 -139.81 119.89 13.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.906 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.412 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 86.2 m-70 -110.22 157.44 19.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.725 179.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 3.1 ttt -127.34 140.55 52.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.95 0.405 . . . . 0.0 111.337 -179.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.67 ' CE1' HD11 ' A' ' 16' ' ' ILE . 97.9 m-85 -150.69 127.77 11.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.572 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.481 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 14.4 t -107.21 132.48 53.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.906 0.384 . . . . 0.0 111.326 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.807 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 3.4 m-85 -122.29 172.32 8.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.646 179.615 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -128.67 26.21 5.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.966 179.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -152.94 119.64 5.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.524 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -55.13 -34.0 63.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.017 0.437 . . . . 0.0 110.937 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.06 -55.29 6.71 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.124 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 48.1 t -60.02 -41.15 85.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.969 0.414 . . . . 0.0 110.198 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.608 ' HE1' ' HB1' ' A' ' 50' ' ' ALA . 0.1 OUTLIER -67.76 -37.15 81.72 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.529 179.632 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.424 ' HA ' ' HG2' ' A' ' 101' ' ' LYS . 84.0 m-20 -76.09 -31.3 58.66 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.967 0.413 . . . . 0.0 111.039 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.421 ' O ' ' HB ' ' A' ' 103' ' ' THR . 94.5 m-20 -59.53 -41.35 89.81 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.379 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.633 HG22 HD12 ' A' ' 104' ' ' LEU . 24.5 mm -65.66 -51.89 57.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.504 179.424 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.887 ' HB3' HD11 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -65.32 -27.13 68.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.476 179.516 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.404 ' N ' ' HG3' ' A' ' 101' ' ' LYS . 43.4 mtm -78.43 -40.28 36.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.708 179.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.439 HG22 HD13 ' A' ' 18' ' ' ILE . 0.6 OUTLIER -76.59 -38.83 54.21 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.63 179.846 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 1.064 HD21 HD22 ' A' ' 42' ' ' LEU . 6.5 mt -61.19 -38.98 88.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.572 179.735 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.668 ' HA ' HD12 ' A' ' 108' ' ' ILE . 1.0 OUTLIER -59.0 -32.33 69.61 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.043 0.449 . . . . 0.0 110.427 179.454 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -66.44 -31.24 71.87 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.056 179.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.521 HG21 ' CB ' ' A' ' 42' ' ' LEU . 10.0 mm -69.22 -56.7 10.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.579 179.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.668 HD12 ' HA ' ' A' ' 105' ' ' GLN . 2.2 mt -50.66 -61.08 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.542 0 CA-C-O 121.783 0.801 . . . . 0.0 109.662 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.2 m -51.66 -28.9 15.94 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 114.235 -1.348 . . . . 0.0 110.674 179.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.404 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 4.1 mtt-85 -67.33 -40.44 85.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.41 179.483 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.407 ' CZ ' ' HB2' ' A' ' 43' ' ' SER . 86.5 m-85 -84.35 -28.28 27.14 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.382 179.489 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.499 ' CE ' HG22 ' A' ' 108' ' ' ILE . 20.2 mttt -63.08 -43.0 99.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.497 179.258 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -61.06 -36.88 80.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.924 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.29 -33.59 74.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.085 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 52.1 t0 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.274 -0.87 . . . . 0.0 110.842 -179.984 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 27.6 tp . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.741 0.305 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 1.3 m -123.57 163.74 32.76 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.867 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -55.27 -40.53 85.17 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.646 2.231 . . . . 0.0 112.215 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -55.15 -22.31 16.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.871 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -66.92 -42.92 84.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.783 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 24.9 mm -71.0 -24.19 24.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.361 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -62.38 -38.47 89.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.857 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.06 -33.65 75.88 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.729 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 53' ' ' TRP . . . . . 0.626 ' CE3' ' HE2' ' A' ' 59' ' ' MET . 12.1 m95 -59.4 -34.13 72.07 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.133 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 54' ' ' PHE . . . . . 0.443 ' CD2' ' NE2' ' A' ' 49' ' ' GLN . 44.0 m-85 -105.65 -3.64 21.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.701 -179.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -91.16 -29.91 16.99 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.805 0.336 . . . . 0.0 110.81 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -80.99 144.28 31.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.844 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 58.76 175.0 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.012 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo . . . . . 0 C--O 1.249 1.027 0 C-N-CA 122.563 2.175 . . . . 0.0 112.305 -179.942 . . . . . . . . 0 0 . 1 stop_ save_