data_2jrj_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 2jrj _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 ' 16' ' ' ASN . . . . . . . . . . . . . 39.6 p30 . . . . . 0 C--O 1.231 0.12 0 N-CA-C 109.649 -0.501 . . . . 0.0 109.649 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.432 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 26.2 t -93.18 108.48 33.23 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.375 175.615 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -72.94 -16.95 25.64 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.246 1.964 . . . . 0.0 111.422 177.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.463 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 16.8 mm -63.18 -23.31 32.96 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.972 -177.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.474 ' SG ' ' HG3' ' A' ' 22' ' ' GLU . 21.7 p -161.69 18.15 0.1 Allowed 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -179.023 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 89.1 mt 59.36 35.22 23.09 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 176.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.474 ' HG3' ' SG ' ' A' ' 20' ' ' CYS . 38.6 mt-10 -103.94 -175.89 2.93 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 175.683 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -80.52 162.62 24.25 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.643 178.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.532 HD12 ' HA ' ' A' ' 40' ' ' LEU . 0.3 OUTLIER -160.77 153.49 4.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 122.909 0.483 . . . . 0.0 110.008 176.435 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.419 ' CE1' ' HB3' ' A' ' 27' ' ' SER . 1.9 p80 -146.42 164.16 33.35 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.31 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.3 p -64.91 -24.18 67.45 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 -171.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.419 ' HB3' ' CE1' ' A' ' 25' ' ' HIS . 32.9 t -59.17 112.82 1.85 Allowed 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.037 0.446 . . . . 0.0 110.668 179.25 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.656 ' HD3' ' H ' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -100.38 16.61 23.9 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.542 -174.63 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.554 HG13 HG23 ' A' ' 30' ' ' VAL . 7.2 p -76.18 -35.59 28.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.155 0.502 . . . . 0.0 109.677 173.511 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.554 HG23 HG13 ' A' ' 29' ' ' VAL . 57.4 t -97.19 -46.88 12.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.072 176.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.11 123.22 26.61 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.437 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -73.67 138.69 44.9 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 21.7 t -89.15 119.89 36.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.793 -178.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.55 HD12 ' HB2' ' A' ' 38' ' ' HIS . 76.6 mt -68.91 152.16 96.92 Favored Pre-proline 0 C--N 1.328 -0.338 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 169.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -66.61 -8.85 22.29 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.286 1.99 . . . . 0.0 112.238 -177.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 42.7 t -100.11 9.97 42.0 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.327 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.52 8.84 63.66 Favored Glycine 0 C--N 1.338 0.679 0 N-CA-C 114.663 0.625 . . . . 0.0 114.663 169.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.566 ' HB3' HD23 ' A' ' 57' ' ' LEU . 62.7 m-70 -94.81 156.89 16.17 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 117.553 0.677 . . . . 0.0 111.079 -178.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.4 mt -113.28 143.06 45.06 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.18 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.532 ' HA ' HD12 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -158.29 142.27 15.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.682 174.986 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.612 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -55.77 154.62 6.78 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.573 0.225 . . . . 0.0 110.602 175.693 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.434 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 15.5 mmt180 -47.8 -54.92 10.9 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.535 -170.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.425 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 92.5 m -56.27 -41.09 75.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.069 0.461 . . . . 0.0 111.121 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.612 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -70.5 -25.48 63.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.966 -177.588 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.503 ' HB2' HD13 ' A' ' 40' ' ' LEU . 45.5 t80 -62.2 -42.65 99.49 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 173.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.468 ' O ' ' HG3' ' A' ' 50' ' ' LYS . 36.7 mt-10 -65.56 -49.23 69.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.584 176.233 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.467 ' HA ' ' HD3' ' A' ' 50' ' ' LYS . 42.4 mt-10 -54.66 -48.19 72.64 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.334 -178.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.476 ' C ' ' SD ' ' A' ' 48' ' ' MET . 0.5 OUTLIER -68.33 -51.9 39.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.493 -177.658 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 53.3 tp -61.83 -28.52 69.54 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.923 -176.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 46' ' ' GLU . 9.6 mtpm? -53.68 -50.07 66.62 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.152 0.501 . . . . 0.0 110.42 173.355 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.423 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 7.4 mm-40 -76.14 -44.46 38.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.031 -176.147 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 69.75 22.78 76.95 Favored Glycine 0 C--N 1.333 0.364 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.641 -176.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.428 ' CE1' ' HG2' ' A' ' 48' ' ' MET . 5.7 p90 -75.67 170.81 15.45 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 122.732 0.413 . . . . 0.0 111.2 -175.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -60.72 124.68 21.14 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.932 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.6 p -65.22 110.13 3.87 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -176.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -67.52 -26.33 40.39 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.636 2.224 . . . . 0.0 112.088 -176.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.566 HD23 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -61.63 -17.63 56.1 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 120.871 0.367 . . . . 0.0 110.72 -177.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.47 0.532 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.214 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 . . . . . 0 C--O 1.233 0.215 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.448 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 27.2 t -72.48 109.34 5.76 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.606 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.65 -15.46 21.66 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.297 1.998 . . . . 0.0 111.353 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.448 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 26.7 mm -63.24 -23.47 33.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.204 -177.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 29.5 p -157.1 12.12 0.23 Allowed 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -179.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 88.2 mt 53.72 69.53 0.7 Allowed 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.326 0.584 . . . . 0.0 110.759 -175.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -146.09 146.06 30.77 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.188 -0.914 . . . . 0.0 108.856 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -67.58 162.57 23.16 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -176.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.7 tt -145.76 146.77 19.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.843 0.354 . . . . 0.0 110.583 -176.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -93.45 144.66 25.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.044 178.468 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 15.4 t -75.59 -18.32 59.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.889 0.376 . . . . 0.0 110.522 178.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.412 ' O ' HG11 ' A' ' 30' ' ' VAL . 9.0 t -63.5 117.67 7.07 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.092 178.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 67.6 ttt-85 -63.7 -31.27 72.39 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.508 -176.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.4 p -60.83 -22.75 27.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -174.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.412 HG11 ' O ' ' A' ' 27' ' ' SER . 7.0 p -106.79 2.53 10.1 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-O 120.888 0.375 . . . . 0.0 111.702 -174.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -138.02 164.84 28.07 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.993 0.425 . . . . 0.0 111.068 -177.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 8.2 t60 -100.41 135.61 41.57 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 174.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 48.8 t -95.21 122.33 46.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.609 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.607 HD13 ' HB2' ' A' ' 38' ' ' HIS . 71.1 mt -72.09 153.2 92.68 Favored Pre-proline 0 C--N 1.325 -0.495 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 173.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -63.49 -17.31 59.45 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.577 2.184 . . . . 0.0 111.746 -178.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.4 t -93.5 7.96 42.55 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.504 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.51 23.7 46.06 Favored Glycine 0 C--N 1.337 0.634 0 CA-C-N 116.257 -0.429 . . . . 0.0 113.668 172.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.607 ' HB2' HD13 ' A' ' 34' ' ' LEU . 43.5 m-70 -103.5 156.99 17.35 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 122.595 -0.356 . . . . 0.0 111.175 178.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 44.4 mt -111.11 142.94 42.62 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.879 177.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.482 HD12 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -160.63 145.3 14.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.821 173.089 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.561 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -58.88 162.27 4.26 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.68 0.276 . . . . 0.0 110.687 176.478 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.474 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 24.4 mmt180 -50.4 -57.12 8.71 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.811 -169.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 24.8 p -59.44 -49.04 79.35 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.39 -177.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.561 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -59.22 -27.95 66.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.56 -176.456 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.482 ' HB2' HD12 ' A' ' 40' ' ' LEU . 31.5 t80 -55.3 -53.64 53.63 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.611 0.72 . . . . 0.0 109.783 174.435 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.474 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 6.4 mm-40 -69.66 -37.66 76.81 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.542 -1.208 . . . . 0.0 110.57 -177.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -62.56 -41.16 98.74 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.53 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 19.5 ttp -75.19 -50.39 16.38 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.026 0.441 . . . . 0.0 110.155 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 48.8 tp -61.55 -28.71 69.53 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.425 -177.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.474 ' HB2' ' O ' ' A' ' 46' ' ' GLU . 22.7 ttmm -57.96 -45.18 87.08 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.076 176.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.9 mm-40 -74.4 -40.81 61.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.158 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 65.19 46.22 88.45 Favored Glycine 0 N--CA 1.451 -0.317 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.374 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 20.8 p90 -104.49 -179.51 3.97 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -64.14 120.17 11.58 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.882 -177.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.6 p -54.59 108.24 1.09 Allowed Pre-proline 0 C--O 1.235 0.315 0 CA-C-O 120.77 0.319 . . . . 0.0 111.845 -178.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -65.16 -19.19 62.78 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 122.784 2.323 . . . . 0.0 112.422 -174.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.573 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -71.59 -11.27 60.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.989 0.423 . . . . 0.0 110.323 -179.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.466 0.341 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.901 173.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 120.891 0.377 . . . . 0.0 110.269 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.551 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 42.8 t -97.74 111.06 57.89 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.641 -177.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -77.5 -12.34 16.94 Favored 'Trans proline' 0 CA--C 1.534 0.504 0 C-N-CA 122.259 1.973 . . . . 0.0 112.129 175.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.551 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 29.0 mm -59.85 -44.47 94.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-O 120.794 0.331 . . . . 0.0 110.808 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.548 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 27.8 p -132.0 15.72 4.7 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.539 -177.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 51.8 mt 52.41 72.28 0.41 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 121.28 0.562 . . . . 0.0 109.591 -175.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.548 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 21.1 tt0 -146.13 -176.45 5.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.311 -171.458 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.479 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 16.0 t70 -86.82 156.35 19.92 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 122.543 0.337 . . . . 0.0 111.308 178.725 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.551 HG13 ' HB2' ' A' ' 17' ' ' CYS . 8.5 mt -148.87 105.1 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 169.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -76.1 136.65 39.85 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.535 -0.542 . . . . 0.0 109.535 172.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.7 m -52.81 -17.69 1.5 Allowed 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -171.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.6 m -52.35 106.42 0.15 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 120.857 0.36 . . . . 0.0 111.338 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -62.61 -24.39 67.56 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.111 -178.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.7 t -53.54 -30.67 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-O 121.079 0.466 . . . . 0.0 110.955 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 60.6 t -106.26 -47.09 8.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.452 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.534 ' HB2' ' HB3' ' A' ' 39' ' ' LEU . . . -79.55 107.0 11.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.703 -178.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.575 ' HB2' HH11 ' A' ' 42' ' ' ARG . 9.4 t60 -69.1 134.99 50.08 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.211 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.2 t -87.15 115.2 27.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.249 -178.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.562 HD11 ' HB2' ' A' ' 38' ' ' HIS . 43.0 mt -72.01 147.82 91.37 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.99 170.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -55.61 -24.64 46.18 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.818 2.345 . . . . 0.0 112.498 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.9 t -88.72 5.92 41.06 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.761 -177.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.24 23.66 33.9 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 121.315 -0.469 . . . . 0.0 113.54 173.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.562 ' HB2' HD11 ' A' ' 34' ' ' LEU . 70.3 m-70 -102.89 155.61 18.23 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.9 0.35 . . . . 0.0 111.013 178.026 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.534 ' HB3' ' HB2' ' A' ' 31' ' ' ALA . 81.1 mt -115.71 136.93 52.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.343 175.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.547 HD12 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -160.26 146.36 15.44 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.747 0.308 . . . . 0.0 111.101 175.222 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.552 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -58.91 157.65 9.51 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.223 178.39 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.575 HH11 ' HB2' ' A' ' 32' ' ' HIS . 26.2 mmt180 -46.57 -58.37 3.87 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.567 -171.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.437 ' O ' ' HG2' ' A' ' 47' ' ' GLU . 28.4 m -57.65 -48.26 79.98 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.003 0.43 . . . . 0.0 110.93 -177.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.552 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -61.01 -28.74 69.26 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.921 -179.214 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.547 ' HB2' HD12 ' A' ' 40' ' ' LEU . 39.6 t80 -65.16 -55.29 19.49 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.501 177.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -61.5 -48.22 82.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.265 -175.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 43' ' ' THR . 48.6 mm-40 -59.69 -45.48 91.95 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -175.804 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 18.9 ttp -65.87 -44.99 83.73 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.029 0.442 . . . . 0.0 110.053 -179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 42.8 tp -68.89 -28.15 66.43 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.766 -179.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.453 ' HB3' ' HE2' ' A' ' 50' ' ' LYS . 4.7 tmmm? -68.45 -33.85 74.92 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.049 179.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -76.98 -56.23 4.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.593 173.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 91.0 14.68 57.44 Favored Glycine 0 C--N 1.332 0.314 0 CA-C-N 115.842 -0.617 . . . . 0.0 113.334 175.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 21.9 p90 -75.38 173.55 10.77 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 117.007 0.404 . . . . 0.0 110.333 177.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 -56.7 128.03 34.42 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.551 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.2 p -54.26 109.62 1.64 Allowed Pre-proline 0 C--O 1.235 0.306 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.546 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.433 ' HG2' HD12 ' A' ' 19' ' ' ILE . 23.9 Cg_endo -60.78 -25.93 82.06 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.729 2.286 . . . . 0.0 112.658 -175.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.555 HD21 ' HB3' ' A' ' 38' ' ' HIS . 3.9 mp -65.46 -15.68 62.88 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 120.902 0.382 . . . . 0.0 110.967 -177.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.465 0.288 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.581 176.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 34.8 p30 . . . . . 0 C--O 1.233 0.189 0 CA-C-O 121.021 0.439 . . . . 0.0 110.391 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.59 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 35.5 t -99.11 109.29 53.72 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.333 -177.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -74.24 -16.56 22.21 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.451 2.101 . . . . 0.0 111.557 175.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.59 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 34.4 mm -61.03 -25.89 37.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.022 -179.048 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 27.6 p -156.7 18.4 0.32 Allowed 'General case' 0 N--CA 1.466 0.349 0 O-C-N 122.41 -0.181 . . . . 0.0 111.335 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 80.2 mt 56.27 39.88 30.07 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.916 0.388 . . . . 0.0 111.507 177.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -118.29 174.33 6.29 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.183 -178.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -67.69 153.51 43.54 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.357 -175.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.483 HD13 ' HA ' ' A' ' 40' ' ' LEU . 1.8 mt -153.87 146.16 14.19 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 CA-C-N 115.287 -0.87 . . . . 0.0 108.986 171.435 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 24.0 m80 -149.25 -170.14 3.55 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 122.328 0.251 . . . . 0.0 110.564 178.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.497 ' O ' ' HD2' ' A' ' 28' ' ' ARG . 51.7 p -62.99 -17.55 62.26 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -173.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.5 m -57.54 99.45 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 111.536 0.199 . . . . 0.0 111.536 -178.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.497 ' HD2' ' O ' ' A' ' 26' ' ' THR . 5.2 mpt_? -71.57 -28.73 64.04 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.191 0.52 . . . . 0.0 110.134 178.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 46.7 t -62.67 -38.14 80.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.079 177.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.531 ' O ' ' HA ' ' A' ' 41' ' ' HIS . 60.9 t -82.32 -62.62 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.85 -0.613 . . . . 0.0 109.658 176.398 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.485 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -85.69 98.72 10.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.491 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -61.98 143.45 56.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.34 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 40.2 t -86.89 115.58 27.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.363 -177.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.604 HD11 ' HB2' ' A' ' 38' ' ' HIS . 32.2 mt -67.39 151.79 96.81 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.812 173.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -59.15 -19.02 47.29 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.87 2.38 . . . . 0.0 111.896 174.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 32.5 t -99.51 18.17 18.55 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.501 -178.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.91 15.19 79.62 Favored Glycine 0 C--N 1.338 0.666 0 N-CA-C 114.706 0.642 . . . . 0.0 114.706 169.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.604 ' HB2' HD11 ' A' ' 34' ' ' LEU . 36.3 m-70 -103.0 157.39 17.01 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 117.58 0.69 . . . . 0.0 111.041 178.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.485 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 97.6 mt -108.57 138.54 44.71 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.849 177.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.521 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -158.91 138.9 12.04 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 122.83 0.452 . . . . 0.0 110.482 174.125 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.531 ' HA ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -56.46 163.5 1.72 Allowed 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.674 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 18.6 mmt180 -43.15 -64.72 0.58 Allowed 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 114.884 -1.053 . . . . 0.0 112.551 -173.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 24.3 p -56.56 -47.47 79.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.114 0.483 . . . . 0.0 110.923 -177.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.496 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.5 OUTLIER -61.98 -28.75 69.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.232 -179.671 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.521 ' HB2' HD13 ' A' ' 40' ' ' LEU . 53.5 t80 -68.63 -53.14 24.42 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.047 0.451 . . . . 0.0 110.034 176.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -62.28 -45.07 94.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.741 -177.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.1 mm-40 -59.85 -54.52 45.28 Favored 'General case' 0 C--O 1.234 0.261 0 O-C-N 123.129 0.268 . . . . 0.0 111.609 178.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.463 ' HA ' ' CE1' ' A' ' 53' ' ' TYR . 6.8 ttp -58.94 -40.79 85.72 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.131 0.491 . . . . 0.0 110.175 -176.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.1 tp -75.85 -29.91 58.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.875 -178.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 50.1 tttm -65.51 -51.11 62.34 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.257 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -71.24 -31.45 67.56 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.932 174.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 62.38 38.59 96.52 Favored Glycine 0 N--CA 1.452 -0.28 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.458 177.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.463 ' CE1' ' HA ' ' A' ' 48' ' ' MET . 41.1 p90 -88.12 -175.95 5.24 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.786 0.327 . . . . 0.0 110.634 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.792 ' H ' ' HD2' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -75.22 144.77 42.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.355 -173.951 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.5 p -84.27 107.09 9.69 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.805 -178.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -67.23 -13.52 39.82 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 122.516 2.144 . . . . 0.0 111.811 179.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.571 HD21 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -74.99 -6.75 51.02 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.44 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.465 0.303 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 173.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.454 -0.226 0 CA-C-O 121.024 0.44 . . . . 0.0 109.981 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.511 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 10.6 t -90.38 108.99 30.54 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.805 -176.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -68.96 -11.37 31.66 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.256 1.971 . . . . 0.0 112.041 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.511 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 26.5 mm -71.87 -21.1 20.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.875 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.417 ' SG ' ' CG ' ' A' ' 22' ' ' GLU . 21.8 p -164.12 17.49 0.06 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 120.944 -0.303 . . . . 0.0 111.776 -179.483 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.419 ' N ' ' O ' ' A' ' 17' ' ' CYS . 60.1 mt 53.67 31.08 12.06 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.417 ' CG ' ' SG ' ' A' ' 20' ' ' CYS . 56.4 mm-40 -101.97 -177.59 3.46 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.23 178.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -74.75 148.4 40.47 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -174.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.493 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.5 mt -149.72 124.0 1.68 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 C-N-CA 123.38 0.672 . . . . 0.0 109.924 170.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 18.1 t-80 -108.5 157.82 18.1 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 177.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.3 p -54.06 -22.48 10.87 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 9.6 m -61.94 100.51 0.16 Allowed 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.018 0.437 . . . . 0.0 110.555 177.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.9 ppt_? -81.18 16.81 1.43 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.532 -176.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 56.4 t -71.21 -47.63 59.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 172.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.411 ' O ' ' HA ' ' A' ' 41' ' ' HIS . 7.8 p -86.1 -38.4 12.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.199 175.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.478 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -86.76 101.86 13.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.67 -179.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -59.52 137.14 58.11 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.362 178.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 30.6 t -86.25 108.81 18.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.593 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.586 HD13 ' HB2' ' A' ' 38' ' ' HIS . 43.2 mt -66.9 151.04 97.4 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.286 173.519 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.4 -24.59 69.42 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.726 2.284 . . . . 0.0 112.237 179.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 43.0 t -91.13 7.73 39.15 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.65 -177.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.98 22.54 45.11 Favored Glycine 0 C--N 1.337 0.588 0 CA-C-N 116.103 -0.499 . . . . 0.0 113.872 172.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.586 ' HB2' HD13 ' A' ' 34' ' ' LEU . 78.0 m-70 -101.64 155.94 17.8 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 117.263 0.531 . . . . 0.0 110.784 177.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.478 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 71.0 mt -115.75 136.38 53.11 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.558 177.066 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.493 ' HA ' HD13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -161.19 140.31 10.19 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.005 175.368 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.585 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -53.65 153.09 4.62 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.604 0.24 . . . . 0.0 111.518 179.354 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.47 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 15.3 mmt180 -44.24 -57.04 3.69 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.941 0.897 . . . . 0.0 112.203 -172.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.455 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 61.1 m -52.7 -49.35 65.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.04 -178.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.585 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -65.1 -30.87 71.85 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.029 -177.914 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.491 ' HB2' HD12 ' A' ' 40' ' ' LEU . 13.3 t80 -60.88 -50.31 73.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.98 175.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.473 ' O ' ' HG3' ' A' ' 50' ' ' LYS . 47.6 mt-10 -64.87 -41.43 95.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.592 -179.239 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 43' ' ' THR . 43.8 mt-10 -55.65 -55.36 33.05 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.998 0.428 . . . . 0.0 110.835 177.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 15.6 ttp -65.49 -40.92 93.63 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.918 -175.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 34.9 tp -73.84 -28.76 61.76 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.552 -173.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.473 ' HG3' ' O ' ' A' ' 46' ' ' GLU . 56.5 mttp -57.26 -47.73 80.68 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.104 0.478 . . . . 0.0 110.049 175.504 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -70.27 -39.18 75.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.61 173.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 64.63 19.76 65.3 Favored Glycine 0 N--CA 1.45 -0.416 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.257 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.2 p90 -70.75 173.94 6.62 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 120.761 0.315 . . . . 0.0 110.651 -177.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 67.9 mtt180 -65.04 122.9 18.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.532 -175.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.4 p -54.12 112.46 3.88 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.772 -173.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -63.73 -24.86 68.68 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.73 2.287 . . . . 0.0 112.332 -178.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.558 HD21 ' HB3' ' A' ' 38' ' ' HIS . 4.6 mp -66.65 -14.42 62.44 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 120.762 0.315 . . . . 0.0 110.823 -178.158 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.467 0.375 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.976 174.113 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.1 p30 . . . . . 0 C--O 1.232 0.135 0 CA-C-O 121.226 0.536 . . . . 0.0 110.568 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.539 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 11.1 t -82.37 108.45 11.86 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.63 177.193 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.85 -11.52 29.53 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.171 1.914 . . . . 0.0 111.539 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.539 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 21.0 mm -69.5 -25.81 29.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.684 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.791 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 17.4 p -165.21 22.77 0.05 Allowed 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -177.025 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 90.9 mt 59.03 24.71 12.99 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 176.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.791 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 0.3 OUTLIER -97.33 171.21 8.56 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 -177.515 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -76.34 150.75 36.84 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.977 0.417 . . . . 0.0 111.239 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.458 HD12 ' O ' ' A' ' 39' ' ' LEU . 7.4 mt -144.12 121.9 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.261 172.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 -105.05 159.71 15.61 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.933 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.526 ' O ' ' HD3' ' A' ' 28' ' ' ARG . 0.9 OUTLIER -59.33 -17.5 29.99 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -177.714 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.3 m -59.63 104.89 0.31 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.631 -0.259 . . . . 0.0 111.687 -177.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.526 ' HD3' ' O ' ' A' ' 26' ' ' THR . 1.7 mpp_? -66.88 -14.61 62.93 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.776 0.322 . . . . 0.0 110.683 176.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 58.4 t -69.99 -33.22 54.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.554 176.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 59.2 t -98.24 -50.58 11.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.275 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.468 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -93.09 113.29 25.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.254 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -62.16 128.29 35.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.739 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.4 ' HA ' HD23 ' A' ' 39' ' ' LEU . 7.2 p -83.66 121.52 36.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.269 0.557 . . . . 0.0 111.337 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.598 HD12 ' HB2' ' A' ' 38' ' ' HIS . 94.9 mt -73.05 154.34 90.72 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.647 174.692 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -62.64 -9.99 17.96 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.779 2.319 . . . . 0.0 112.251 178.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.8 t -107.23 17.46 22.88 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.207 0.527 . . . . 0.0 109.847 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.56 -14.89 63.75 Favored Glycine 0 C--N 1.341 0.84 0 N-CA-C 114.966 0.746 . . . . 0.0 114.966 168.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.598 ' HB2' HD12 ' A' ' 34' ' ' LEU . 14.2 m-70 -81.78 156.7 24.8 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 117.572 0.686 . . . . 0.0 111.385 -173.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.468 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 97.5 mt -109.65 145.27 36.77 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.282 177.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.501 HD11 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -157.96 152.43 24.73 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 174.047 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.459 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -70.59 171.81 9.64 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.76 0.314 . . . . 0.0 111.379 -179.577 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.461 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 12.3 mmm180 -46.48 -67.25 0.3 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.775 -173.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 22.3 m -60.71 -43.86 97.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.06 0.457 . . . . 0.0 110.681 -175.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.459 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.6 OUTLIER -63.68 -23.94 67.58 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.586 -176.27 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.501 ' HB2' HD11 ' A' ' 40' ' ' LEU . 34.4 t80 -61.4 -50.3 73.42 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 173.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -67.67 -41.21 84.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.721 -179.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -56.62 -51.03 70.23 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.489 -177.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.415 ' HE3' HD11 ' A' ' 34' ' ' LEU . 13.6 ttp -70.18 -49.52 49.55 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.933 0.397 . . . . 0.0 110.656 -177.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.4 tp -62.2 -34.77 77.1 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.913 -176.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -55.06 -48.04 74.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.286 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -68.9 -43.9 74.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.208 177.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.78 18.89 79.42 Favored Glycine 0 CA--C 1.519 0.287 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.861 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.431 ' CE2' ' HD3' ' A' ' 56' ' ' PRO . 13.7 p90 -79.06 176.9 9.23 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 178.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 79.2 mtp180 -62.41 119.47 9.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.613 0.244 . . . . 0.0 110.353 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 0.5 OUTLIER -51.37 113.87 4.41 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.51 178.426 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.431 ' HD3' ' CE2' ' A' ' 53' ' ' TYR . 35.0 Cg_endo -63.78 -17.59 60.51 Favored 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 122.519 2.146 . . . . 0.0 111.534 -178.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.45 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.8 mp -75.92 -2.66 31.35 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.143 179.074 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.49 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.463 0.223 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 171.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.537 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 32.6 m-80 . . . . . 0 CA--C 1.519 -0.221 0 CA-C-O 120.932 0.396 . . . . 0.0 110.723 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.554 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 12.8 t -71.2 110.23 6.93 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.518 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.537 ' HD3' ' O ' ' A' ' 16' ' ' ASN . 5.0 Cg_exo -75.06 -13.44 21.28 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.547 2.164 . . . . 0.0 110.864 174.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.554 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 11.9 mm -66.0 -27.0 39.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.856 -176.522 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.444 ' SG ' ' OE2' ' A' ' 22' ' ' GLU . 18.3 p -165.15 20.41 0.05 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 111.672 0.249 . . . . 0.0 111.672 -178.664 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 90.8 mt 55.73 89.65 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.81 0.338 . . . . 0.0 111.186 -177.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.444 ' OE2' ' SG ' ' A' ' 20' ' ' CYS . 26.6 mt-10 -157.09 171.86 19.7 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.651 -179.571 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -83.3 145.62 28.99 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.996 175.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 34.2 mt -138.75 111.73 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.34 173.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -80.35 150.92 29.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.683 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 16.3 p -57.74 -17.87 17.96 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -177.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.4 m -66.3 97.21 0.39 Allowed 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.735 0.302 . . . . 0.0 110.934 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.561 ' HD3' ' H ' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -78.09 11.41 2.31 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.101 0.477 . . . . 0.0 111.344 -179.046 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 37.4 t -74.39 -45.36 46.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 172.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.6 p -87.58 -44.81 16.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.052 178.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.85 112.89 18.65 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.233 -0.439 . . . . 0.0 109.946 177.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.409 ' O ' HD11 ' A' ' 40' ' ' LEU . 19.2 t60 -61.08 131.02 49.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.298 -178.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.418 ' HA ' HD21 ' A' ' 39' ' ' LEU . 7.3 p -86.36 120.61 36.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.017 179.226 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.58 HD11 ' HB2' ' A' ' 38' ' ' HIS . 76.2 mt -74.86 153.37 86.96 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.074 173.26 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.5 -18.13 58.91 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.295 1.996 . . . . 0.0 111.674 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 37.0 t -90.76 9.03 31.67 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.328 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.18 19.21 57.79 Favored Glycine 0 C--N 1.338 0.666 0 CA-C-N 116.112 -0.495 . . . . 0.0 114.127 171.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.58 ' HB2' HD11 ' A' ' 34' ' ' LEU . 61.2 m-70 -104.18 157.15 17.32 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 117.4 0.6 . . . . 0.0 111.1 177.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.418 HD21 ' HA ' ' A' ' 33' ' ' VAL . 93.5 mt -113.52 143.93 43.7 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.358 175.32 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.528 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -159.18 148.02 18.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.477 175.615 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.558 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.1 OUTLIER -58.25 151.76 18.71 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.446 175.858 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.46 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 17.5 mmt85 -47.84 -57.44 5.64 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.842 0.714 . . . . 0.0 112.092 -170.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.437 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 20.2 m -53.63 -40.43 65.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.171 0.51 . . . . 0.0 111.387 -178.289 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.558 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -72.14 -25.35 61.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.999 -176.058 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.528 ' HB2' HD13 ' A' ' 40' ' ' LEU . 20.5 t80 -61.2 -46.64 89.62 Favored 'General case' 0 C--O 1.232 0.143 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 173.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.73 -51.0 71.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.288 176.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 43' ' ' THR . 42.4 mt-10 -54.65 -55.87 25.03 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.615 -177.085 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 10.1 ttp -63.35 -44.95 93.38 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.777 -175.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 64.9 tp -64.09 -34.02 77.09 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.649 -177.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.689 ' HZ2' ' HB3' ' A' ' 50' ' ' LYS . 8.8 mtpm? -67.86 -50.23 57.65 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.972 0.415 . . . . 0.0 110.658 176.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -63.61 -29.35 70.61 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.85 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 60.93 23.71 61.79 Favored Glycine 0 C--N 1.332 0.319 0 CA-C-N 115.829 -0.623 . . . . 0.0 113.328 174.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -85.8 169.21 13.58 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 110.333 -0.247 . . . . 0.0 110.333 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 38.0 mmt180 -58.1 127.22 30.99 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.709 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 1.2 p -60.79 106.33 0.76 Allowed Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.214 178.285 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -65.93 -18.08 56.75 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.714 2.276 . . . . 0.0 112.272 -174.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.559 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.7 mp -68.76 -17.3 64.02 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.153 178.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.7 OUTLIER . . . . . 0 N--CA 1.468 0.465 0 CA-C-O 120.991 0.425 . . . . 0.0 110.422 174.23 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.1 p30 . . . . . 0 C--O 1.233 0.197 0 CA-C-O 121.112 0.482 . . . . 0.0 109.865 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.453 ' HB2' HG13 ' A' ' 24' ' ' ILE . 33.3 t -85.98 111.09 35.67 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.793 -178.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.492 ' HG2' ' HG ' ' A' ' 57' ' ' LEU . 17.2 Cg_exo -64.91 -19.01 63.9 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.353 2.036 . . . . 0.0 111.398 179.268 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.476 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 11.7 mm -76.65 -12.41 14.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.812 -173.328 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.457 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 20.2 p -171.68 19.36 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 77.9 mt 60.08 16.35 5.86 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 176.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.457 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 27.6 mm-40 -97.0 173.28 7.36 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.564 0.221 . . . . 0.0 111.105 -177.016 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -69.83 153.52 43.2 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 116.172 -0.467 . . . . 0.0 112.087 -175.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.453 HG13 ' HB2' ' A' ' 17' ' ' CYS . 4.3 mt -150.32 131.53 4.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 123.558 0.743 . . . . 0.0 109.431 172.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 52.3 m80 -114.46 168.85 9.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.83 177.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 14.5 t -70.23 -17.2 63.13 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.656 -175.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.7 p -69.32 133.12 47.46 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.644 177.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.63 ' HD2' ' H ' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -97.74 11.14 38.17 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.383 -176.915 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 64.0 t -58.67 -50.05 80.49 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-O 120.954 0.407 . . . . 0.0 110.289 178.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 49.4 t -100.95 -32.77 3.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.073 177.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.573 ' HA ' ' HA ' ' A' ' 41' ' ' HIS . . . -86.72 104.54 16.21 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.285 -178.293 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.2 t60 -65.21 131.53 46.75 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.3 p -89.56 115.46 29.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.025 0.441 . . . . 0.0 110.743 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.606 HD11 ' HB2' ' A' ' 38' ' ' HIS . 86.6 mt -64.5 153.41 86.94 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.086 175.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -67.26 -10.59 29.15 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.27 1.98 . . . . 0.0 111.364 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 38.6 t -97.03 9.67 41.43 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.386 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.95 17.38 59.64 Favored Glycine 0 C--N 1.338 0.68 0 N-CA-C 114.33 0.492 . . . . 0.0 114.33 171.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.606 ' HB2' HD11 ' A' ' 34' ' ' LEU . 25.4 m-70 -103.84 156.08 18.11 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 117.499 0.649 . . . . 0.0 110.945 178.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 71.5 mt -112.9 135.92 53.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.946 0.403 . . . . 0.0 110.95 176.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.488 HD21 HD12 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -155.09 137.0 14.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.11 173.654 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.573 ' HA ' ' HA ' ' A' ' 31' ' ' ALA . 0.0 OUTLIER -58.0 163.48 2.75 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.884 0.374 . . . . 0.0 111.934 -177.952 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.436 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 16.1 mmm180 -37.59 -69.01 0.13 Allowed 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 114.463 -1.244 . . . . 0.0 113.204 -174.301 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 53.3 m -63.22 -35.74 81.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.005 0.431 . . . . 0.0 111.292 -174.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.501 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -68.45 -24.05 64.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.175 -177.284 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.436 ' HB3' ' O ' ' A' ' 42' ' ' ARG . 30.1 t80 -60.82 -43.71 97.86 Favored 'General case' 0 C--O 1.232 0.179 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 173.191 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.434 ' HB3' ' HE2' ' A' ' 50' ' ' LYS . 41.6 mt-10 -64.43 -48.46 75.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.091 177.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.554 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 43.6 mt-10 -54.04 -57.01 12.65 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.501 -176.184 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 11.4 ttp -63.96 -47.72 79.31 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.064 0.459 . . . . 0.0 110.574 -175.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.0 tp -61.73 -38.16 86.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.284 -175.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.434 ' HE2' ' HB3' ' A' ' 46' ' ' GLU . 68.9 mttm -71.25 -35.37 71.4 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.57 0.224 . . . . 0.0 111.017 -179.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.554 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 8.1 mm-40 -59.52 -31.59 69.53 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.004 0.43 . . . . 0.0 110.487 178.053 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.59 -4.34 60.55 Favored Glycine 0 CA--C 1.518 0.261 0 CA-C-N 115.797 -0.638 . . . . 0.0 114.065 171.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -73.12 166.75 22.51 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 117.677 0.738 . . . . 0.0 110.723 179.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 63.3 mtm180 -65.44 135.62 55.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.246 -0.434 . . . . 0.0 109.89 177.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.458 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 0.9 OUTLIER -54.14 109.72 1.69 Allowed Pre-proline 0 C--N 1.327 -0.37 0 O-C-N 123.304 0.377 . . . . 0.0 112.01 -178.195 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -66.49 -17.62 53.56 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.64 2.226 . . . . 0.0 111.877 -178.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.546 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -70.82 -8.71 54.49 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.177 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.458 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.465 0.301 0 CA-C-O 121.292 0.568 . . . . 0.0 109.85 174.245 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 . . . . . 0 CA--C 1.52 -0.196 0 CA-C-O 120.945 0.403 . . . . 0.0 109.995 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.617 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 13.4 t -96.78 110.52 53.82 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.134 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -68.63 -20.82 40.22 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.188 1.925 . . . . 0.0 111.097 175.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.617 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 19.3 mm -63.67 -25.51 38.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.241 -177.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.48 ' SG ' ' CG ' ' A' ' 22' ' ' GLU . 18.7 p -166.42 25.41 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.709 0.29 . . . . 0.0 111.597 -179.336 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 61.1 mt 54.78 21.96 3.88 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 112.867 0.692 . . . . 0.0 112.867 176.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.48 ' CG ' ' SG ' ' A' ' 20' ' ' CYS . 35.5 mm-40 -93.17 162.58 13.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.732 0.301 . . . . 0.0 110.962 -178.32 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -62.94 151.67 38.78 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.801 -179.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.2 mt -148.6 124.13 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.41 173.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -105.07 172.03 7.01 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 110.083 -0.339 . . . . 0.0 110.083 175.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.4 m -71.32 -18.75 62.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.724 -174.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.472 ' OG ' HG11 ' A' ' 29' ' ' VAL . 20.6 t -58.23 106.81 0.41 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 120.961 0.41 . . . . 0.0 110.87 -179.45 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.5 8.21 17.27 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.212 -175.407 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.472 HG11 ' OG ' ' A' ' 27' ' ' SER . 14.6 p -81.94 -38.95 16.21 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-O 121.006 0.432 . . . . 0.0 109.836 174.701 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.4 p -94.22 -44.46 13.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.013 177.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -87.47 97.9 11.09 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 175.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 8.8 t60 -58.49 127.36 31.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.498 -176.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.1 p -81.97 114.31 22.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.134 0.493 . . . . 0.0 110.736 179.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.596 HD13 ' HB2' ' A' ' 38' ' ' HIS . 76.8 mt -65.17 152.8 90.79 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.147 174.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.44 -3.65 12.24 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.348 2.032 . . . . 0.0 111.287 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 36.1 t -105.49 10.11 33.32 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.278 178.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 87.57 16.01 60.89 Favored Glycine 0 C--N 1.339 0.706 0 N-CA-C 114.92 0.728 . . . . 0.0 114.92 170.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.596 ' HB2' HD13 ' A' ' 34' ' ' LEU . 43.8 m-70 -104.3 156.5 17.86 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 117.759 0.779 . . . . 0.0 110.84 177.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 95.4 mt -113.3 137.19 51.86 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 122.533 0.333 . . . . 0.0 110.717 177.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.513 HD12 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -156.24 141.05 17.1 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.251 174.326 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.54 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -55.72 159.34 3.08 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.915 0.388 . . . . 0.0 111.701 179.71 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.502 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 21.5 mmt85 -42.4 -66.07 0.4 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 114.856 -1.065 . . . . 0.0 112.999 -172.217 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 25.2 m -61.67 -37.91 85.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.913 0.387 . . . . 0.0 111.056 -174.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.54 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -66.72 -26.83 67.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.945 179.852 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.513 ' HB2' HD12 ' A' ' 40' ' ' LEU . 38.2 t80 -63.7 -48.61 76.39 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 174.071 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -61.74 -43.78 98.19 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.171 179.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.552 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 79.2 mm-40 -57.93 -56.58 20.16 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.844 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 8.5 ttp -61.52 -44.56 96.84 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.097 0.475 . . . . 0.0 110.411 -175.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 49.2 tp -66.39 -32.02 73.15 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.297 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.3 ttpp -68.64 -42.91 77.33 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.56 177.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.552 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 30.2 mm-40 -65.58 -37.81 87.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.836 177.522 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 64.8 39.09 96.35 Favored Glycine 0 C--N 1.333 0.379 0 CA-C-N 115.589 -0.732 . . . . 0.0 113.132 176.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 6.3 p90 -106.62 177.46 4.85 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.645 0.259 . . . . 0.0 110.693 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 34.6 mmt180 -64.39 119.18 9.87 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.004 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.452 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 0.8 OUTLIER -55.63 107.83 1.0 Allowed Pre-proline 0 CA--C 1.532 0.26 0 O-C-N 123.333 0.396 . . . . 0.0 111.513 -179.169 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -63.8 -21.18 69.41 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 122.697 2.265 . . . . 0.0 111.829 -175.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.568 HD21 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -69.48 -11.3 60.71 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.434 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.452 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.466 0.335 0 CA-C-O 121.159 0.504 . . . . 0.0 110.211 176.353 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.7 p30 . . . . . 0 C--O 1.232 0.173 0 CA-C-O 120.924 0.392 . . . . 0.0 110.082 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.538 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 39.1 t -91.07 108.1 25.81 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.183 174.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -72.68 -12.55 26.76 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.206 1.937 . . . . 0.0 111.189 176.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.538 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 14.3 mm -71.34 -15.18 18.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.988 -178.427 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.427 ' SG ' ' CG ' ' A' ' 22' ' ' GLU . 18.0 p -173.55 22.49 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 179.413 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 88.1 mt 58.73 24.66 12.49 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 176.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.427 ' CG ' ' SG ' ' A' ' 20' ' ' CYS . 42.9 mm-40 -99.15 159.92 14.64 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.668 0.271 . . . . 0.0 111.43 -177.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.25 148.27 52.08 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.206 177.3 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.481 HD13 ' O ' ' A' ' 39' ' ' LEU . 7.4 mt -138.44 120.8 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-O 121.087 0.47 . . . . 0.0 110.558 174.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 23.2 m80 -99.18 175.22 5.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.983 174.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 49.3 p -75.29 -39.65 59.46 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -173.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 35.5 t -45.32 117.85 1.53 Allowed 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.459 0.474 . . . . 0.0 112.202 -173.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.48 ' HA ' ' O ' ' A' ' 31' ' ' ALA . 0.0 OUTLIER -60.51 -20.83 61.43 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.053 179.463 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.2 t -57.55 -47.92 84.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-O 120.988 0.423 . . . . 0.0 110.397 179.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.515 ' O ' ' HA ' ' A' ' 41' ' ' HIS . 60.0 t -91.32 -50.59 12.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.324 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.5 ' HB3' ' HB3' ' A' ' 39' ' ' LEU . . . -99.79 102.78 14.31 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.06 -177.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.6 t60 -66.45 138.65 57.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.755 176.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 8.6 p -90.73 122.32 41.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-O 121.293 0.568 . . . . 0.0 111.254 -178.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.612 HD13 ' HB2' ' A' ' 38' ' ' HIS . 70.1 mt -72.28 154.56 92.0 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.615 174.324 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -58.03 -24.18 64.31 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 122.621 2.214 . . . . 0.0 112.201 177.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 48.0 t -89.72 9.03 28.71 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.575 -178.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.74 22.43 53.3 Favored Glycine 0 C--N 1.337 0.594 0 C-N-CA 121.415 -0.422 . . . . 0.0 113.665 173.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.612 ' HB2' HD13 ' A' ' 34' ' ' LEU . 71.4 m-70 -101.37 157.26 16.93 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 122.449 -0.442 . . . . 0.0 110.95 177.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.5 ' HB3' ' HB3' ' A' ' 31' ' ' ALA . 95.1 mt -112.56 137.38 50.87 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.982 174.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.516 HD11 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -154.28 142.83 20.73 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 174.205 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.515 ' HA ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -62.94 159.86 16.03 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.778 0.323 . . . . 0.0 111.576 -179.88 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.517 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 24.9 mmm180 -37.39 -67.64 0.18 Allowed 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 114.772 -1.104 . . . . 0.0 113.378 -174.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 89.4 m -60.95 -42.46 98.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.929 0.395 . . . . 0.0 111.154 -175.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.503 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -63.28 -25.73 68.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.078 -177.514 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.517 ' HB3' ' O ' ' A' ' 42' ' ' ARG . 44.3 t80 -60.13 -47.02 87.66 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 174.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -67.23 -42.73 83.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.183 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -54.93 -55.28 32.4 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.291 -178.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 15.5 ttp -68.64 -48.09 64.94 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.72 -175.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 39.2 tp -64.82 -28.95 69.91 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.858 -176.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -62.67 -43.31 99.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.263 0.554 . . . . 0.0 110.107 177.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -75.61 -38.45 59.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.713 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 67.32 28.4 73.67 Favored Glycine 0 CA--C 1.519 0.314 0 CA-C-N 115.857 -0.611 . . . . 0.0 112.776 178.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 17.1 p90 -85.11 176.89 8.12 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.407 ' O ' ' HD3' ' A' ' 56' ' ' PRO . 19.7 ptp180 -59.17 136.29 57.91 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 -179.331 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.5 p -72.62 107.15 2.73 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-O 120.615 0.245 . . . . 0.0 111.57 -177.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.407 ' HD3' ' O ' ' A' ' 54' ' ' ARG . 48.7 Cg_endo -67.45 -18.47 49.36 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.585 2.19 . . . . 0.0 111.927 -176.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.543 HD23 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -69.78 -15.67 63.16 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.553 -179.447 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.466 0.359 0 CA-C-O 120.984 0.421 . . . . 0.0 110.197 176.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.4 p30 . . . . . 0 C--O 1.234 0.258 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.417 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 40.7 t -96.76 107.64 38.11 Favored Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 110.224 -0.287 . . . . 0.0 110.224 177.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.15 -16.01 28.61 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.165 1.91 . . . . 0.0 111.447 178.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.417 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 17.2 mm -64.01 -27.2 42.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.746 -179.189 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.441 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 23.3 p -157.57 16.96 0.26 Allowed 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.345 -178.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 88.9 mt 55.89 29.26 13.84 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.053 0.541 . . . . 0.0 112.351 178.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.441 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 35.2 mm-40 -105.98 174.88 5.69 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.152 0.501 . . . . 0.0 111.933 -178.141 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -71.84 148.51 46.12 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.099 -0.955 . . . . 0.0 112.48 -174.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.2 mt -149.19 149.1 15.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 123.695 0.798 . . . . 0.0 109.04 174.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 45.1 m-70 -120.93 150.1 41.61 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 110.0 -0.371 . . . . 0.0 110.0 179.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.6 m -63.52 -17.4 62.75 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.25 -0.432 . . . . 0.0 112.078 -174.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.4 m -66.21 111.4 3.43 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.931 0.396 . . . . 0.0 110.932 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.452 ' HG2' HD23 ' A' ' 39' ' ' LEU . 64.8 mtm180 -72.82 -9.4 58.63 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.291 -176.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.9 p -71.32 -32.5 47.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.234 178.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.4 p -94.13 -36.35 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 CA-C-O 120.764 0.316 . . . . 0.0 111.227 -177.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -101.69 144.25 30.63 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.579 -178.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -72.31 131.77 43.13 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.3 p -93.46 124.55 45.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.065 0.459 . . . . 0.0 111.662 -175.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.595 HD11 ' HB2' ' A' ' 38' ' ' HIS . 55.0 mt -81.23 152.84 71.37 Favored Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.624 173.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -71.59 -2.59 11.58 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.734 2.289 . . . . 0.0 112.096 -178.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 46.6 t -104.04 9.27 36.54 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.068 176.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.3 23.14 49.24 Favored Glycine 0 C--N 1.336 0.563 0 CA-C-N 116.073 -0.512 . . . . 0.0 113.445 172.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.595 ' HB2' HD11 ' A' ' 34' ' ' LEU . 50.9 m-70 -104.19 156.01 18.25 Favored 'General case' 0 C--N 1.328 -0.335 0 O-C-N 122.538 -0.39 . . . . 0.0 111.239 177.763 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.452 HD23 ' HG2' ' A' ' 28' ' ' ARG . 60.7 mt -117.35 141.13 48.69 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.318 174.476 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.527 HD11 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -157.48 146.57 19.84 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.303 175.225 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.474 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -60.15 159.69 9.31 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.814 0.34 . . . . 0.0 111.071 179.794 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.432 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 21.7 mmt180 -47.37 -55.54 8.67 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.072 -0.967 . . . . 0.0 112.684 -168.528 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.408 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 60.5 m -65.71 -48.08 73.2 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 120.742 0.306 . . . . 0.0 111.149 -177.739 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.474 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -56.39 -28.2 58.53 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.164 -178.202 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.527 ' HB2' HD11 ' A' ' 40' ' ' LEU . 60.5 t80 -59.32 -53.04 62.76 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.263 0.554 . . . . 0.0 109.935 174.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -65.1 -36.47 84.42 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.673 -176.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 43' ' ' THR . 42.0 mt-10 -61.82 -54.92 35.58 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.816 -179.144 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 25.6 ttp -64.32 -44.76 90.53 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.962 0.41 . . . . 0.0 110.284 -178.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 55.9 tp -63.69 -34.79 78.63 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.829 -178.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.8 ttpp -60.49 -46.53 89.78 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.098 0.475 . . . . 0.0 109.99 177.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -66.79 -35.1 79.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.079 177.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 62.2 33.78 87.02 Favored Glycine 0 C--N 1.333 0.402 0 CA-C-N 115.626 -0.716 . . . . 0.0 112.866 176.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -96.75 176.1 6.12 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.631 0.216 . . . . 0.0 110.452 179.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.8 mtm180 -58.28 123.11 14.95 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.904 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.4 p -53.91 108.28 1.08 Allowed Pre-proline 0 CA--C 1.533 0.299 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.804 -179.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.06 -16.85 57.23 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 122.89 2.393 . . . . 0.0 112.859 -174.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.556 HD23 ' HB3' ' A' ' 38' ' ' HIS . 4.8 mp -70.45 -16.82 62.97 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 121.054 0.454 . . . . 0.0 110.315 178.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.466 0.341 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.226 173.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.402 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 9.3 p30 . . . . . 0 C--O 1.234 0.267 0 CA-C-O 120.801 0.334 . . . . 0.0 110.475 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.484 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 18.2 t -87.08 110.03 29.82 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.077 171.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.402 ' HD3' ' O ' ' A' ' 16' ' ' ASN . 2.6 Cg_exo -74.85 -18.45 19.12 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.508 2.139 . . . . 0.0 110.896 176.346 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.484 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 15.9 mm -61.7 -25.56 37.29 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.377 -175.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.475 ' SG ' ' HG3' ' A' ' 22' ' ' GLU . 18.3 p -164.81 18.22 0.05 Allowed 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.266 -177.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 80.6 mt 49.91 83.68 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.21 0.529 . . . . 0.0 111.642 -175.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.475 ' HG3' ' SG ' ' A' ' 20' ' ' CYS . 35.3 mt-10 -144.95 155.7 43.56 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.811 176.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -71.91 141.31 49.51 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 123.693 0.621 . . . . 0.0 110.512 175.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 10.0 mt -136.32 136.47 48.98 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.604 176.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.495 ' HD2' ' HB2' ' A' ' 27' ' ' SER . 2.2 p-80 -113.88 145.33 41.62 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.138 177.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.8 m -59.28 -15.91 18.52 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -173.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.495 ' HB2' ' HD2' ' A' ' 25' ' ' HIS . 14.8 m -45.47 108.52 0.13 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.288 0.566 . . . . 0.0 111.049 177.778 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.404 ' NH2' HG23 ' A' ' 33' ' ' VAL . 9.4 tpt180 -69.63 -30.01 67.63 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.532 -165.365 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 45.8 t -76.28 -19.71 15.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.888 0.375 . . . . 0.0 111.211 -174.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 94.3 t -99.8 -46.62 12.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.09 -179.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.35 113.37 23.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.197 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -65.97 138.14 57.62 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.972 -178.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.404 HG23 ' NH2' ' A' ' 28' ' ' ARG . 7.3 p -93.8 131.53 40.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.271 0.558 . . . . 0.0 111.997 -176.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.627 HD11 ' HB2' ' A' ' 38' ' ' HIS . 60.4 mt -81.79 146.36 56.09 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.302 169.6 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -55.9 -20.85 30.98 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 122.591 2.194 . . . . 0.0 112.107 177.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.3 t -92.54 10.3 30.86 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.646 -177.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.59 17.91 59.4 Favored Glycine 0 C--N 1.337 0.61 0 N-CA-C 114.372 0.509 . . . . 0.0 114.372 170.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.627 ' HB2' HD11 ' A' ' 34' ' ' LEU . 47.3 m-70 -103.37 157.33 17.1 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 117.489 0.645 . . . . 0.0 110.671 177.673 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 91.6 mt -113.45 140.0 48.46 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.878 0.371 . . . . 0.0 110.881 177.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.489 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -152.33 159.18 43.5 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.733 176.476 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.46 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -71.95 168.83 17.17 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.65 0.262 . . . . 0.0 111.066 179.527 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 25.4 mmt180 -44.31 -62.26 1.23 Allowed 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.158 -0.928 . . . . 0.0 112.005 -174.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.6 m -64.77 -49.43 70.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.381 -175.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.46 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -56.47 -27.06 55.94 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.921 -0.581 . . . . 0.0 112.072 -176.003 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.489 ' HB2' HD13 ' A' ' 40' ' ' LEU . 42.4 t80 -58.18 -51.18 70.82 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.691 0.757 . . . . 0.0 109.64 173.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -71.81 -39.1 70.08 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.446 -1.252 . . . . 0.0 110.642 -176.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.47 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 42.5 mt-10 -57.7 -56.41 22.34 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.627 179.008 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 19.8 ttp -63.25 -45.11 93.07 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.127 -176.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 29.0 tp -66.45 -31.24 71.87 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.934 -176.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.3 ttpp -68.8 -48.27 64.04 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.121 178.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 6.2 mm-40 -64.76 -36.38 84.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.067 178.541 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.13 29.82 68.29 Favored Glycine 0 C--N 1.332 0.339 0 CA-C-N 115.604 -0.726 . . . . 0.0 113.626 173.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.411 ' CD1' ' HB2' ' A' ' 51' ' ' GLU . 39.0 p90 -89.18 169.81 11.14 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 117.045 0.423 . . . . 0.0 110.639 178.202 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 55.6 mtp180 -63.79 125.86 25.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.62 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -55.68 108.8 1.29 Allowed Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.838 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -65.61 -17.44 56.92 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 122.852 2.368 . . . . 0.0 112.389 -177.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.551 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -72.47 -8.43 55.03 Favored 'General case' 0 CA--C 1.528 0.112 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.545 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.466 0.363 0 CA-C-O 120.837 0.351 . . . . 0.0 110.563 177.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.403 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 33.4 p30 . . . . . 0 C--O 1.233 0.214 0 CA-C-O 121.522 0.677 . . . . 0.0 111.565 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 10.5 t -87.79 108.46 20.86 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.481 172.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.403 ' HD3' ' O ' ' A' ' 16' ' ' ASN . 22.4 Cg_exo -63.54 -28.89 70.39 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.407 2.071 . . . . 0.0 111.26 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 8.5 mm -57.14 -23.09 17.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.759 -173.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.4 p -158.08 14.76 0.21 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 120.702 0.287 . . . . 0.0 110.937 178.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 90.3 mt 45.9 67.55 0.73 Allowed 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.543 0.687 . . . . 0.0 111.618 -176.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -136.06 -177.92 4.91 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 114.986 -1.006 . . . . 0.0 109.971 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -77.54 151.93 34.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.882 0.372 . . . . 0.0 111.641 -177.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.452 HD11 ' HA ' ' A' ' 40' ' ' LEU . 2.9 mt -147.72 146.08 18.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.274 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.333 172.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.439 ' CG ' ' H ' ' A' ' 26' ' ' THR . 3.5 t-160 -127.69 -178.66 4.57 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.448 0.166 . . . . 0.0 110.762 -177.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.439 ' H ' ' CG ' ' A' ' 25' ' ' HIS . 6.3 m -72.61 -33.2 66.53 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -167.195 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.5 t -59.08 117.59 4.88 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 120.894 0.378 . . . . 0.0 112.002 -171.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.511 ' HG3' HD22 ' A' ' 39' ' ' LEU . 6.8 mpt_? -76.8 -6.9 54.18 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.897 176.511 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.5 t -87.17 -35.02 7.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.698 178.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.1 t -81.4 -55.26 8.39 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.883 176.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -94.66 125.38 39.27 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.697 177.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -67.89 133.03 48.44 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 -178.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.7 p -87.57 116.62 30.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-O 121.106 0.479 . . . . 0.0 111.008 179.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.554 HD13 ' HB2' ' A' ' 38' ' ' HIS . 73.3 mt -65.7 155.42 86.14 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.462 175.396 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.26 -14.76 25.73 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.791 2.327 . . . . 0.0 112.423 178.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 48.9 t -101.57 11.02 39.7 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.78 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 83.45 22.22 56.87 Favored Glycine 0 C--N 1.335 0.511 0 CA-C-N 116.224 -0.444 . . . . 0.0 114.153 171.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.572 ' HB3' HD22 ' A' ' 57' ' ' LEU . 48.7 m-70 -103.01 156.66 17.52 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 117.281 0.54 . . . . 0.0 110.909 177.406 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.511 HD22 ' HG3' ' A' ' 28' ' ' ARG . 80.4 mt -113.11 141.25 47.13 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.865 0.364 . . . . 0.0 110.79 177.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.532 HD12 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -157.85 150.15 22.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.949 175.263 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.492 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -64.64 165.33 10.42 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.703 0.287 . . . . 0.0 111.433 179.339 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.446 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 10.0 mmm180 -48.88 -66.26 0.43 Allowed 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.121 -0.945 . . . . 0.0 112.876 -171.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 48.1 m -58.06 -40.89 82.14 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.962 0.41 . . . . 0.0 110.842 -175.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.492 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.5 OUTLIER -65.94 -29.57 70.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.81 179.755 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.532 ' HB2' HD12 ' A' ' 40' ' ' LEU . 20.8 t80 -63.46 -55.6 22.88 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.394 178.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -59.24 -49.4 77.98 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.967 -175.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.427 ' HA ' ' HD3' ' A' ' 50' ' ' LYS . 7.3 mm-40 -57.19 -43.34 82.61 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.988 -178.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.436 ' SD ' ' C ' ' A' ' 48' ' ' MET . 0.7 OUTLIER -68.72 -44.48 73.79 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 121.069 0.462 . . . . 0.0 110.358 178.898 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.459 ' O ' HD12 ' A' ' 49' ' ' LEU . 2.3 tm? -66.2 -33.66 76.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.625 -174.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.427 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 46.6 mtpt -59.15 -34.36 71.99 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.968 178.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -96.15 -38.72 10.04 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.983 -177.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 65.12 26.95 71.77 Favored Glycine 0 CA--C 1.518 0.261 0 CA-C-N 115.99 -0.55 . . . . 0.0 112.375 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 33.7 p90 -70.71 177.92 3.32 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 122.425 0.29 . . . . 0.0 111.166 -177.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.419 ' O ' ' HD3' ' A' ' 56' ' ' PRO . 15.2 mmt180 -56.65 121.57 10.05 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.837 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.2 p -73.46 105.83 1.93 Allowed Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.413 -178.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.419 ' HD3' ' O ' ' A' ' 54' ' ' ARG . 46.4 Cg_endo -66.8 -13.79 41.28 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 122.58 2.187 . . . . 0.0 112.156 -176.655 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.572 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -73.54 -14.94 61.3 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.296 179.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.478 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.459 177.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 39.9 p30 . . . . . 0 N--CA 1.464 0.237 0 CA-C-O 121.163 0.506 . . . . 0.0 111.108 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.449 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 44.8 t -108.79 108.16 60.57 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.593 172.377 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -74.01 -14.97 23.59 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.264 1.976 . . . . 0.0 111.469 177.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.449 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 23.3 mm -64.44 -24.13 34.96 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.046 -177.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.0 p -161.16 10.81 0.09 Allowed 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 -177.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 9.3 mp 54.76 94.12 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.314 0.578 . . . . 0.0 110.569 -172.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -160.02 164.35 33.28 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.859 -178.069 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -73.83 137.55 43.87 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.734 -179.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.2 mt -141.12 148.33 21.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 174.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -134.98 166.0 24.04 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.0 m -52.06 -17.03 0.89 Allowed 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 122.994 0.518 . . . . 0.0 112.05 177.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.3 m -48.73 86.79 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.328 0.651 . . . . 0.0 111.882 179.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 50.2 ttp180 -81.1 -4.95 56.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.894 -176.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 47.9 t -80.27 -36.84 16.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.267 0.556 . . . . 0.0 109.741 175.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.2 t -88.65 -54.41 7.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.531 177.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.94 117.83 18.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.123 -179.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 48.4 t60 -69.52 127.56 33.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.036 -179.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.9 p -88.45 118.6 34.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.245 0.545 . . . . 0.0 111.284 -177.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.563 HD11 ' HB2' ' A' ' 38' ' ' HIS . 92.7 mt -62.81 150.4 87.4 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.755 172.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -59.05 -12.76 16.52 Favored 'Trans proline' 0 CA--C 1.535 0.537 0 C-N-CA 122.712 2.275 . . . . 0.0 112.953 177.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.3 t -96.91 6.69 48.18 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.77 0.319 . . . . 0.0 110.801 178.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.14 19.99 47.94 Favored Glycine 0 C--N 1.337 0.632 0 N-CA-C 114.286 0.474 . . . . 0.0 114.286 172.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.563 ' HB2' HD11 ' A' ' 34' ' ' LEU . 39.9 m-70 -104.0 156.87 17.51 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 117.505 0.652 . . . . 0.0 110.981 178.01 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.6 mt -113.65 137.07 52.12 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.79 0.328 . . . . 0.0 111.189 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.548 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -157.24 157.5 34.41 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.859 174.661 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.498 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -72.31 166.65 22.04 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.174 -179.693 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.486 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 26.3 mmm180 -49.13 -64.02 0.93 Allowed 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -172.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.486 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 27.2 m -60.56 -41.56 94.82 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.572 0.225 . . . . 0.0 110.628 -175.432 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.498 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -62.34 -27.57 69.15 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 120.884 0.373 . . . . 0.0 110.479 178.535 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.548 ' HB2' HD13 ' A' ' 40' ' ' LEU . 25.0 t80 -70.74 -44.76 66.13 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.933 174.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -66.9 -27.9 67.87 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.677 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.486 ' HG3' ' O ' ' A' ' 43' ' ' THR . 43.9 mt-10 -73.21 -51.79 16.46 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.24 175.136 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.446 ' SD ' ' C ' ' A' ' 48' ' ' MET . 0.6 OUTLIER -62.32 -54.27 42.94 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.894 -176.776 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 65.6 tp -61.72 -28.44 69.42 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.095 -177.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.699 ' HZ2' ' HB2' ' A' ' 50' ' ' LYS . 4.6 ttmp? -61.49 -40.63 95.29 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.057 0.456 . . . . 0.0 110.579 178.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -88.25 -33.12 18.19 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.011 -178.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 61.64 29.95 73.41 Favored Glycine 0 C--N 1.334 0.466 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.307 -178.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.479 ' HB2' ' NH1' ' A' ' 54' ' ' ARG . 16.0 p90 -82.52 174.04 11.43 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 120.806 0.336 . . . . 0.0 111.154 -175.351 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.479 ' NH1' ' HB2' ' A' ' 53' ' ' TYR . 0.3 OUTLIER -57.44 138.79 54.62 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.747 177.939 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -90.37 107.17 18.08 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -175.353 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -63.63 -15.0 46.07 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.781 2.321 . . . . 0.0 112.192 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.536 HD23 ' HB3' ' A' ' 38' ' ' HIS . 4.9 mp -75.38 -6.64 51.01 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.418 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.466 0.337 0 CA-C-O 121.014 0.435 . . . . 0.0 109.869 173.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.4 p30 . . . . . 0 N--CA 1.457 -0.121 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.493 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 22.1 t -82.92 108.78 13.54 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.365 177.324 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -74.89 -7.42 19.23 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.269 1.979 . . . . 0.0 111.437 179.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.493 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 21.3 mm -72.3 -22.98 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.41 178.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.691 ' SG ' ' HG3' ' A' ' 22' ' ' GLU . 21.3 p -163.09 22.62 0.09 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 120.726 0.298 . . . . 0.0 111.574 -179.528 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 7.1 mp 57.32 25.93 11.79 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 174.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.691 ' HG3' ' SG ' ' A' ' 20' ' ' CYS . 54.0 mt-10 -93.28 -179.42 5.06 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 120.712 0.291 . . . . 0.0 110.62 178.257 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -90.39 149.53 22.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.406 177.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.4 mt -137.08 137.19 46.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 175.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 18.3 t60 -111.82 156.47 21.93 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 -177.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.5 t -56.7 -16.96 7.3 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -177.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.0 t -61.65 93.88 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.137 0.494 . . . . 0.0 110.839 -178.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 50.0 ttp180 -76.61 -14.32 60.0 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.625 -178.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.8 p -68.57 -19.03 23.87 Favored 'Isoleucine or valine' 0 C--O 1.238 0.447 0 CA-C-O 121.473 0.654 . . . . 0.0 109.495 173.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 61.2 t -99.09 -63.14 1.72 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.533 173.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.77 123.05 21.77 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.21 -178.017 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -76.17 140.31 41.67 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.804 178.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.402 ' HA ' ' O ' ' A' ' 38' ' ' HIS . 7.5 p -98.05 120.13 46.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-O 121.183 0.516 . . . . 0.0 111.308 -179.421 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.594 HD13 ' HB2' ' A' ' 38' ' ' HIS . 84.6 mt -61.27 148.65 84.88 Favored Pre-proline 0 C--O 1.233 0.215 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.022 172.742 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -56.8 -19.68 32.27 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.595 2.197 . . . . 0.0 112.45 179.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 46.7 t -88.98 0.35 56.73 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.975 -178.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.35 19.33 28.24 Favored Glycine 0 C--N 1.335 0.502 0 C-N-CA 121.41 -0.424 . . . . 0.0 114.084 174.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.594 ' HB2' HD13 ' A' ' 34' ' ' LEU . 54.6 m-70 -103.32 156.62 17.6 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 117.424 0.612 . . . . 0.0 111.241 179.412 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.0 mt -112.98 139.8 48.33 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 120.848 0.356 . . . . 0.0 111.445 178.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.543 HD12 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -162.86 149.04 12.37 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.579 176.178 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.567 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -58.9 158.43 8.33 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.042 175.547 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.519 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 9.9 mmt85 -50.91 -58.24 6.5 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 115.729 -0.668 . . . . 0.0 112.241 -170.316 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.435 ' O ' ' HG2' ' A' ' 47' ' ' GLU . 26.6 m -55.84 -44.25 77.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.238 -177.716 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.567 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -62.44 -31.9 72.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.764 179.267 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.543 ' HB2' HD12 ' A' ' 40' ' ' LEU . 34.5 t80 -62.34 -47.67 83.19 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.845 175.554 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -62.35 -51.47 67.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.56 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 43' ' ' THR . 23.0 mm-40 -62.84 -37.18 85.78 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.583 -177.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.453 ' SD ' ' C ' ' A' ' 48' ' ' MET . 0.5 OUTLIER -67.89 -51.36 48.93 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.255 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.4 tp -66.64 -28.42 68.46 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.589 -179.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -57.5 -50.62 72.47 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.371 177.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.5 mm-40 -79.92 -32.73 40.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.46 178.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 61.8 32.86 83.29 Favored Glycine 0 C--N 1.331 0.276 0 CA-C-N 115.91 -0.587 . . . . 0.0 112.46 179.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 22.8 p90 -77.66 -175.93 4.1 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.858 0.361 . . . . 0.0 110.727 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.489 ' HD2' ' N ' ' A' ' 54' ' ' ARG . 2.4 mpt_? -72.73 122.37 21.39 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -177.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.4 p -61.8 107.3 1.07 Allowed Pre-proline 0 C--N 1.329 -0.323 0 O-C-N 123.102 0.251 . . . . 0.0 111.273 -178.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -59.84 -28.9 88.26 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.748 2.299 . . . . 0.0 112.163 -173.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.554 HD21 ' HB3' ' A' ' 38' ' ' HIS . 4.6 mp -62.61 -16.81 58.42 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.952 0.406 . . . . 0.0 110.85 -177.161 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.466 0.328 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.617 176.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.836 0.35 . . . . 0.0 110.354 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.442 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 43.5 t -92.27 108.19 28.95 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.704 176.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -76.52 -8.67 18.43 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.246 1.964 . . . . 0.0 111.617 177.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.442 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 20.6 mm -70.91 -23.12 23.43 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.943 -177.58 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.468 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 21.4 p -162.18 12.63 0.08 Allowed 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -177.391 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 7.5 mp 54.97 91.02 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.215 0.531 . . . . 0.0 109.92 -171.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.468 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 0.4 OUTLIER -155.37 167.48 30.24 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.361 -174.134 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -88.92 143.32 26.95 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.708 0.29 . . . . 0.0 110.401 179.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.4 mt -142.48 142.24 27.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -123.74 177.6 5.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.276 179.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 15.2 t -75.81 -15.82 60.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.593 -173.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.5 m -57.52 89.91 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 120.927 0.394 . . . . 0.0 111.224 179.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.443 ' HG2' HD23 ' A' ' 39' ' ' LEU . 82.8 mtt85 -71.81 -11.48 60.83 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.055 -177.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 66.6 t -66.74 -35.31 74.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.232 0.539 . . . . 0.0 109.994 173.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 40.0 t -94.08 -53.69 8.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.951 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -84.54 116.8 23.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.061 178.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -65.38 124.82 23.26 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.273 -177.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.479 ' HA ' HD21 ' A' ' 39' ' ' LEU . 7.3 p -80.73 116.94 25.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.099 0.476 . . . . 0.0 110.95 178.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.598 HD12 ' HB2' ' A' ' 38' ' ' HIS . 76.2 mt -65.98 154.91 88.42 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.046 174.149 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -67.99 -5.55 14.91 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.323 2.015 . . . . 0.0 111.475 178.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 30.2 t -106.03 14.49 27.76 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.402 178.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.66 2.53 75.69 Favored Glycine 0 C--N 1.341 0.846 0 N-CA-C 114.948 0.739 . . . . 0.0 114.948 169.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.598 ' HB2' HD12 ' A' ' 34' ' ' LEU . 25.9 m-70 -96.95 156.83 16.18 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 117.525 0.662 . . . . 0.0 111.339 -175.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.479 HD21 ' HA ' ' A' ' 33' ' ' VAL . 98.1 mt -114.0 142.57 46.0 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.876 178.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.509 HD12 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -157.04 152.12 26.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.862 175.872 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.519 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -66.15 167.82 9.48 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.991 178.761 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.493 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 15.4 mmm180 -50.17 -60.45 2.95 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.174 -169.233 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 28.3 m -66.22 -41.43 90.09 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.247 -175.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.519 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -60.8 -26.38 67.25 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 120.77 0.319 . . . . 0.0 110.694 -178.941 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.509 ' HB2' HD12 ' A' ' 40' ' ' LEU . 39.5 t80 -59.67 -48.84 80.1 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.008 174.566 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -65.82 -44.31 85.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.629 -179.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -57.8 -51.69 68.52 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.925 -178.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 9.5 tmm? -65.0 -49.39 70.43 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.19 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 54.1 tp -62.12 -31.1 71.53 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.103 -177.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.4 ttmm -63.58 -40.44 96.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.918 0.389 . . . . 0.0 110.272 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -75.62 -41.4 54.41 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.363 176.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.87 45.92 94.32 Favored Glycine 0 C--N 1.333 0.388 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 -176.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -102.91 -175.71 2.89 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.784 0.325 . . . . 0.0 110.513 -175.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.444 ' HG3' ' O ' ' A' ' 54' ' ' ARG . 34.8 ptt180 -56.78 110.6 0.83 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.296 177.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.427 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 0.8 OUTLIER -64.81 105.48 0.74 Allowed Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.731 -0.213 . . . . 0.0 110.646 178.936 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -59.49 -22.51 66.66 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 122.806 2.337 . . . . 0.0 112.408 -172.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.543 HD21 ' HB3' ' A' ' 38' ' ' HIS . 4.3 mp -66.93 -20.55 65.92 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.518 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.7 OUTLIER . . . . . 0 N--CA 1.466 0.372 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.096 174.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.449 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 12.9 m120 . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.904 0.383 . . . . 0.0 111.078 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.442 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 44.1 t -80.4 109.41 12.66 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.497 175.251 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.503 ' HG2' ' HG2' ' A' ' 56' ' ' PRO . 92.5 Cg_endo -80.86 -4.92 12.96 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.454 2.103 . . . . 0.0 111.665 177.22 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.442 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 19.0 mm -72.96 -20.29 18.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.705 -178.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.708 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 21.2 p -163.61 17.69 0.07 Allowed 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.243 -179.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.442 ' N ' HD11 ' A' ' 21' ' ' LEU . 6.4 mp 49.08 80.0 0.07 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.164 0.506 . . . . 0.0 109.969 -174.052 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.708 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 0.5 OUTLIER -150.24 170.67 18.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.66 -173.078 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -82.93 137.49 34.19 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 122.889 0.475 . . . . 0.0 111.406 -177.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 26.6 mt -136.72 131.32 47.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 109.641 -0.504 . . . . 0.0 109.641 171.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 66.7 m170 -117.37 178.73 4.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.588 178.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.9 t -65.46 -17.31 64.45 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -174.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 67.7 m -60.12 94.52 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.055 0.455 . . . . 0.0 111.562 -178.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.6 mtt85 -80.45 17.29 1.11 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.667 -178.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.6 t -88.94 -51.8 11.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.122 0.487 . . . . 0.0 109.705 173.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 57.6 t -84.32 -38.18 13.49 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.977 177.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.412 ' HB2' ' HB3' ' A' ' 39' ' ' LEU . . . -82.19 97.65 8.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.801 175.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.4 ' O ' HD11 ' A' ' 40' ' ' LEU . 9.3 t60 -61.11 136.48 58.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.912 -178.547 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.7 p -89.76 124.69 42.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.213 0.53 . . . . 0.0 111.222 -177.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.61 HD11 ' HB2' ' A' ' 38' ' ' HIS . 60.5 mt -76.27 151.85 83.65 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.408 174.515 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.5 -22.5 35.01 Favored 'Trans proline' 0 CA--C 1.535 0.531 0 C-N-CA 122.58 2.186 . . . . 0.0 112.295 175.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.2 t -95.46 12.8 28.1 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.853 -177.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 83.8 15.6 70.01 Favored Glycine 0 C--N 1.337 0.627 0 N-CA-C 114.5 0.56 . . . . 0.0 114.5 170.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.61 ' HB2' HD11 ' A' ' 34' ' ' LEU . 59.3 m-70 -100.01 156.62 17.06 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 117.555 0.678 . . . . 0.0 110.619 178.044 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.412 ' HB3' ' HB2' ' A' ' 31' ' ' ALA . 97.1 mt -112.66 142.5 45.19 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.674 176.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.522 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -159.27 140.79 13.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.784 175.006 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.511 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -54.18 155.42 3.68 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.648 0.261 . . . . 0.0 111.413 179.115 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.498 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 55.1 mmm-85 -36.35 -66.57 0.21 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.26 1.024 . . . . 0.0 113.284 -173.265 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 30.8 m -64.53 -36.58 84.65 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.762 0.315 . . . . 0.0 111.486 -172.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.511 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -64.14 -28.54 69.83 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.736 -178.942 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.522 ' HB2' HD13 ' A' ' 40' ' ' LEU . 32.3 t80 -58.49 -50.03 75.22 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.818 175.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -66.63 -41.61 88.04 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.232 -178.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.409 ' O ' ' HB3' ' A' ' 50' ' ' LYS . 19.2 mm-40 -56.58 -54.99 39.58 Favored 'General case' 0 C--O 1.235 0.335 0 O-C-N 123.332 0.395 . . . . 0.0 111.724 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 14.7 ttp -61.67 -49.67 75.57 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.141 0.496 . . . . 0.0 110.338 -178.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 32.0 tp -64.7 -28.61 69.72 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.539 -178.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.409 ' HB3' ' O ' ' A' ' 47' ' ' GLU . 34.7 ttpt -63.61 -47.85 79.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.405 177.357 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -75.4 -26.95 58.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.75 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 62.9 25.97 68.38 Favored Glycine 0 C--N 1.331 0.304 0 CA-C-N 115.956 -0.565 . . . . 0.0 113.27 175.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 20.0 p90 -83.71 176.12 9.19 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 178.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 32.3 mtp180 -70.3 130.6 42.42 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 -176.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.405 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 1.5 p -60.37 107.4 1.03 Allowed Pre-proline 0 CA--C 1.532 0.258 0 CA-C-O 120.663 0.268 . . . . 0.0 111.553 -178.542 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.503 ' HG2' ' HG2' ' A' ' 18' ' ' PRO . 39.5 Cg_endo -66.19 -18.21 55.7 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.757 2.304 . . . . 0.0 112.32 -175.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.572 HD21 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -69.88 -13.25 62.16 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 120.937 0.399 . . . . 0.0 110.182 179.247 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.465 0.314 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.319 173.262 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 . . . . . 0 N--CA 1.456 -0.132 0 CA-C-O 121.159 0.504 . . . . 0.0 110.624 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.409 ' HB2' HG13 ' A' ' 24' ' ' ILE . 33.4 t -72.6 110.07 7.41 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.759 177.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.559 ' HG2' ' HG ' ' A' ' 57' ' ' LEU . 15.6 Cg_exo -67.62 -19.94 47.51 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.464 2.109 . . . . 0.0 111.373 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.458 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 10.4 mm -70.04 -18.39 21.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.387 -174.514 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.582 ' SG ' ' HG3' ' A' ' 22' ' ' GLU . 19.1 p -167.87 21.95 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 121.047 -0.261 . . . . 0.0 111.689 -178.331 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 89.3 mt 55.98 28.69 13.07 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.582 ' HG3' ' SG ' ' A' ' 20' ' ' CYS . 39.0 mt-10 -91.54 -177.73 4.89 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 177.072 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -91.94 151.56 20.46 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.889 0.376 . . . . 0.0 110.475 175.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.409 HG13 ' HB2' ' A' ' 17' ' ' CYS . 15.2 mt -143.05 111.98 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 173.06 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 35.4 t60 -89.88 150.91 22.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.178 -177.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 12.9 m -53.36 -25.46 15.38 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.085 -177.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.8 p -64.74 89.47 0.07 Allowed 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.09 0.471 . . . . 0.0 110.367 177.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.2 ppt_? -78.22 18.96 0.47 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.997 -175.408 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.8 p -73.05 -30.95 33.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-O 121.206 0.527 . . . . 0.0 109.687 172.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.0 p -101.62 -38.55 6.01 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.436 177.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -82.6 111.11 18.28 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.51 179.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -64.82 133.52 52.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.117 -179.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.3 p -92.1 122.14 43.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.082 0.468 . . . . 0.0 111.131 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.572 HD13 ' HB2' ' A' ' 38' ' ' HIS . 82.7 mt -67.81 155.08 92.42 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.639 172.119 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.41 -12.82 35.02 Favored 'Trans proline' 0 CA--C 1.531 0.357 0 C-N-CA 122.102 1.868 . . . . 0.0 111.736 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 38.4 t -100.74 13.69 34.07 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.593 -179.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.19 17.34 65.03 Favored Glycine 0 C--N 1.336 0.578 0 N-CA-C 114.458 0.543 . . . . 0.0 114.458 169.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.581 ' HB3' HD21 ' A' ' 57' ' ' LEU . 41.9 m-70 -103.27 156.11 17.96 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 117.53 0.665 . . . . 0.0 110.421 177.426 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.5 mt -112.01 144.6 41.09 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.849 0.357 . . . . 0.0 111.252 -179.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.539 HD12 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -163.31 151.47 13.62 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.301 175.551 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.557 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -69.83 163.28 26.2 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.886 178.165 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.469 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 57.3 mmm-85 -48.53 -57.67 5.81 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 123.822 0.701 . . . . 0.0 112.183 -174.576 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 42.8 p -52.73 -57.04 11.4 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.423 0.63 . . . . 0.0 110.599 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.557 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.5 OUTLIER -58.15 -26.67 62.99 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.111 -0.95 . . . . 0.0 111.679 -179.971 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.539 ' HB2' HD12 ' A' ' 40' ' ' LEU . 39.6 t80 -66.71 -48.98 67.51 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 177.427 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -63.98 -43.57 95.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.455 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -57.2 -53.05 62.46 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.138 178.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.431 ' SD ' ' C ' ' A' ' 48' ' ' MET . 1.0 OUTLIER -65.61 -50.87 63.47 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.618 -177.063 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 42.8 tp -62.85 -30.28 71.38 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.715 -177.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 45.8 tttm -62.1 -51.48 67.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.127 0.489 . . . . 0.0 110.214 175.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.406 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 11.0 mm-40 -67.25 -35.44 79.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.641 -177.102 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 63.34 24.48 67.51 Favored Glycine 0 CA--C 1.519 0.32 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.937 176.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.406 ' HD1' ' HB2' ' A' ' 51' ' ' GLU . 14.8 p90 -79.77 163.4 24.49 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.512 ' H ' ' HD3' ' A' ' 54' ' ' ARG . 0.8 OUTLIER -61.07 130.33 45.8 Favored 'General case' 0 C--N 1.332 -0.152 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 -179.496 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.2 p -64.65 114.06 13.11 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.148 -174.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -67.96 -24.8 39.1 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.735 2.29 . . . . 0.0 111.879 -178.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.581 HD21 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -65.25 -15.79 62.86 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.62 -178.313 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.467 0.388 0 CA-C-O 120.871 0.367 . . . . 0.0 110.676 175.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 . . . . . 0 N--CA 1.455 -0.209 0 CA-C-O 121.204 0.526 . . . . 0.0 110.396 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.518 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 18.8 t -78.31 111.05 15.94 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.267 179.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -72.87 -12.98 26.55 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.214 1.943 . . . . 0.0 111.677 177.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.518 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 24.4 mm -71.35 -19.23 20.66 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.155 -178.07 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.6 p -168.31 20.5 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 120.962 -0.295 . . . . 0.0 111.775 -179.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.437 ' N ' HD11 ' A' ' 21' ' ' LEU . 6.3 mp 48.26 72.72 0.25 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.009 0.433 . . . . 0.0 110.716 -177.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -146.64 -176.62 5.26 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.379 -173.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -78.12 139.29 39.02 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.086 -176.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.453 HD11 ' O ' ' A' ' 39' ' ' LEU . 11.9 mt -145.43 140.31 22.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.288 169.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 22.8 m80 -145.46 173.47 11.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.635 0.255 . . . . 0.0 110.605 176.09 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 63.2 m -60.0 -24.64 64.62 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.802 -0.636 . . . . 0.0 112.691 -173.305 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -55.4 98.69 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.186 0.517 . . . . 0.0 110.853 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.49 -25.19 66.58 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.714 -174.693 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.451 HG12 HG22 ' A' ' 30' ' ' VAL . 13.6 p -58.27 -31.27 42.01 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-O 121.084 0.469 . . . . 0.0 110.162 179.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.451 HG22 HG12 ' A' ' 29' ' ' VAL . 73.0 t -96.61 -49.47 12.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.008 177.218 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.524 ' HB3' ' HB3' ' A' ' 39' ' ' LEU . . . -94.59 103.79 15.74 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.088 -177.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -66.56 139.37 57.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.855 178.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 52.4 t -87.19 120.85 37.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-O 120.735 0.302 . . . . 0.0 111.279 -178.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.563 HD12 ' HB2' ' A' ' 38' ' ' HIS . 55.2 mt -73.45 152.82 89.92 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.331 172.749 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -64.11 1.15 1.69 Allowed 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 123.241 2.627 . . . . 0.0 113.583 -178.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 47.7 t -115.7 4.26 14.03 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.781 0.325 . . . . 0.0 110.818 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.48 24.23 26.72 Favored Glycine 0 C--N 1.335 0.505 0 C-N-CA 121.219 -0.515 . . . . 0.0 113.987 173.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.563 ' HB2' HD12 ' A' ' 34' ' ' LEU . 69.1 m-70 -103.48 155.52 18.45 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 117.115 0.457 . . . . 0.0 110.669 174.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.524 ' HB3' ' HB3' ' A' ' 31' ' ' ALA . 88.8 mt -113.01 142.68 45.43 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.451 177.333 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.537 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -158.04 140.4 14.39 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.759 174.362 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.561 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -55.55 156.2 4.87 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.865 0.364 . . . . 0.0 111.096 -179.653 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.549 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 8.6 mmm180 -43.75 -59.81 2.07 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 114.857 -1.065 . . . . 0.0 113.098 -168.588 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 18.5 m -67.24 -37.65 83.9 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.605 0.241 . . . . 0.0 111.442 -174.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.561 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -62.19 -27.41 68.95 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.904 0.383 . . . . 0.0 110.289 179.243 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.549 ' HB3' ' O ' ' A' ' 42' ' ' ARG . 41.8 t80 -60.85 -47.45 86.32 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.103 175.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -60.85 -45.87 92.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.409 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.442 ' HA ' ' HE2' ' A' ' 50' ' ' LYS . 11.7 mm-40 -63.6 -40.02 95.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.849 -177.142 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.429 ' SD ' ' C ' ' A' ' 48' ' ' MET . 8.5 tmm? -72.64 -51.2 20.55 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.147 0.498 . . . . 0.0 109.708 179.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.8 tp -60.29 -27.69 67.49 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.617 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.442 ' HE2' ' HA ' ' A' ' 47' ' ' GLU . 17.3 ttmm -49.64 -38.73 33.49 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.226 177.018 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.8 mm-40 -93.73 -38.76 11.13 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.942 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 63.02 20.73 62.86 Favored Glycine 0 C--N 1.333 0.391 0 C-N-CA 121.14 -0.552 . . . . 0.0 112.418 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -71.14 -173.7 0.88 Allowed 'General case' 0 C--O 1.237 0.419 0 CA-C-O 120.88 0.371 . . . . 0.0 111.576 -178.567 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.49 136.32 58.01 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 175.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.414 ' HA ' ' HD2' ' A' ' 56' ' ' PRO . 0.8 OUTLIER -80.99 108.53 10.45 Favored Pre-proline 0 C--N 1.323 -0.562 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -172.253 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.414 ' HD2' ' HA ' ' A' ' 55' ' ' CYS . 27.5 Cg_endo -61.45 -20.95 70.52 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.468 2.112 . . . . 0.0 112.084 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.506 HD21 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -70.86 -12.08 61.33 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.724 -178.332 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.469 0.498 0 CA-C-O 121.234 0.54 . . . . 0.0 110.264 176.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 28.8 p-10 . . . . . 0 C--O 1.234 0.275 0 CA-C-O 121.305 0.574 . . . . 0.0 110.482 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 17.4 t -90.8 109.69 36.44 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.225 176.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.499 ' HG2' ' HG ' ' A' ' 57' ' ' LEU . 20.6 Cg_exo -64.75 -25.72 60.83 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.387 2.058 . . . . 0.0 111.775 179.772 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.477 HD11 HD11 ' A' ' 57' ' ' LEU . 10.3 mm -62.81 -28.03 44.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 115.179 -0.919 . . . . 0.0 111.591 -173.565 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.1 p -155.59 12.1 0.33 Allowed 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 111.588 0.218 . . . . 0.0 111.588 -178.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 76.1 mt 52.37 79.56 0.11 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 122.838 0.455 . . . . 0.0 111.65 -177.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -144.32 167.6 22.06 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.227 -177.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -73.95 132.07 42.07 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.783 -177.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.9 mt -137.64 126.18 33.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 C-N-CA 122.927 0.491 . . . . 0.0 109.774 174.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 66.2 m170 -116.29 -172.46 2.18 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.941 0.401 . . . . 0.0 111.231 -178.188 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.9 t -61.24 -17.66 54.44 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.676 -176.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.3 t -59.8 99.51 0.07 Allowed 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.994 0.426 . . . . 0.0 111.101 -177.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.406 ' C ' ' HD2' ' A' ' 28' ' ' ARG . 0.7 OUTLIER -88.81 -1.92 58.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.435 178.2 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.3 p -89.95 -38.44 11.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.391 179.141 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 93.8 t -75.28 -54.94 12.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 175.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -86.85 137.37 32.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.161 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.9 t60 -73.96 134.1 43.09 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -179.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 9.0 p -96.14 121.89 47.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-O 121.267 0.556 . . . . 0.0 111.113 -178.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.58 HD11 ' HB2' ' A' ' 38' ' ' HIS . 86.1 mt -70.58 155.87 92.76 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.445 175.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -65.3 -15.73 51.32 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 122.341 2.027 . . . . 0.0 111.813 178.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 46.5 t -93.63 8.42 40.92 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.334 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 83.32 23.66 53.72 Favored Glycine 0 C--N 1.336 0.548 0 CA-C-N 116.006 -0.543 . . . . 0.0 114.056 172.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.58 ' HB2' HD11 ' A' ' 34' ' ' LEU . 44.9 m-70 -103.81 155.57 18.5 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 117.303 0.551 . . . . 0.0 110.271 175.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 61.3 mt -113.49 138.22 50.43 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.443 176.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.523 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -156.75 149.29 23.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.82 175.648 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.43 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -68.58 168.92 12.0 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.06 179.73 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.46 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 8.3 mmt180 -53.05 -60.73 2.92 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.651 -168.564 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 28.8 m -61.73 -43.8 98.16 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.992 0.425 . . . . 0.0 110.856 -178.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.43 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.5 OUTLIER -61.84 -26.47 68.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.2 -178.374 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.523 ' HB2' HD13 ' A' ' 40' ' ' LEU . 48.3 t80 -62.17 -49.51 75.55 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.214 0.53 . . . . 0.0 109.578 173.34 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -59.64 -46.56 88.62 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.188 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -56.63 -56.16 24.86 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.882 -175.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 15.4 ttp -64.96 -47.03 79.08 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.256 0.55 . . . . 0.0 110.47 -175.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 61.6 tp -66.42 -28.84 68.93 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.834 -177.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -65.21 -46.41 80.81 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.961 0.41 . . . . 0.0 110.586 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.457 ' HB2' ' CD1' ' A' ' 53' ' ' TYR . 14.1 mm-40 -65.52 -23.81 66.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.802 -177.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 63.18 43.13 99.07 Favored Glycine 0 C--N 1.331 0.27 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.832 176.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.457 ' CD1' ' HB2' ' A' ' 51' ' ' GLU . 3.3 p90 -118.16 161.34 20.02 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.417 ' CD ' ' H ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -55.75 137.48 49.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.269 0.557 . . . . 0.0 111.107 179.803 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -63.39 115.67 19.85 Favored Pre-proline 0 CA--C 1.535 0.387 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.671 -171.495 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -66.46 -12.4 35.57 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 122.895 2.397 . . . . 0.0 112.356 -179.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.575 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.4 mp -79.28 -8.23 58.9 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 110.295 -0.261 . . . . 0.0 110.295 178.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.468 0.446 0 CA-C-O 120.894 0.378 . . . . 0.0 110.247 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 . . . . . 0 N--CA 1.479 0.98 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -74.48 84.67 2.01 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.033 0.444 . . . . 0.0 110.375 -177.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 34.1 m -94.35 -15.15 7.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.728 179.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 70.0 m -69.32 -16.69 63.6 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.028 178.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -108.29 118.44 36.78 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 176.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.2 mm-40 -76.99 162.45 27.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.86 -169.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 39.6 p30 -139.61 162.69 34.49 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.649 178.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.432 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 26.2 t -93.18 108.48 33.23 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.375 175.615 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -72.94 -16.95 25.64 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.246 1.964 . . . . 0.0 111.422 177.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.463 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 16.8 mm -63.18 -23.31 32.96 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.972 -177.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.474 ' SG ' ' HG3' ' A' ' 22' ' ' GLU . 21.7 p -161.69 18.15 0.1 Allowed 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -179.023 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 89.1 mt 59.36 35.22 23.09 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 176.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.474 ' HG3' ' SG ' ' A' ' 20' ' ' CYS . 38.6 mt-10 -103.94 -175.89 2.93 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 175.683 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -80.52 162.62 24.25 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.643 178.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.532 HD12 ' HA ' ' A' ' 40' ' ' LEU . 0.3 OUTLIER -160.77 153.49 4.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 122.909 0.483 . . . . 0.0 110.008 176.435 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.419 ' CE1' ' HB3' ' A' ' 27' ' ' SER . 1.9 p80 -146.42 164.16 33.35 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.31 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.3 p -64.91 -24.18 67.45 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 -171.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.419 ' HB3' ' CE1' ' A' ' 25' ' ' HIS . 32.9 t -59.17 112.82 1.85 Allowed 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.037 0.446 . . . . 0.0 110.668 179.25 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.656 ' HD3' ' H ' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -100.38 16.61 23.9 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.542 -174.63 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.554 HG13 HG23 ' A' ' 30' ' ' VAL . 7.2 p -76.18 -35.59 28.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.155 0.502 . . . . 0.0 109.677 173.511 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.554 HG23 HG13 ' A' ' 29' ' ' VAL . 57.4 t -97.19 -46.88 12.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.072 176.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.11 123.22 26.61 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.437 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -73.67 138.69 44.9 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 21.7 t -89.15 119.89 36.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.793 -178.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.55 HD12 ' HB2' ' A' ' 38' ' ' HIS . 76.6 mt -68.91 152.16 96.92 Favored Pre-proline 0 C--N 1.328 -0.338 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 169.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -66.61 -8.85 22.29 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.286 1.99 . . . . 0.0 112.238 -177.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 42.7 t -100.11 9.97 42.0 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.327 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.52 8.84 63.66 Favored Glycine 0 C--N 1.338 0.679 0 N-CA-C 114.663 0.625 . . . . 0.0 114.663 169.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.566 ' HB3' HD23 ' A' ' 57' ' ' LEU . 62.7 m-70 -94.81 156.89 16.17 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 117.553 0.677 . . . . 0.0 111.079 -178.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.4 mt -113.28 143.06 45.06 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.18 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.532 ' HA ' HD12 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -158.29 142.27 15.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.682 174.986 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.612 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -55.77 154.62 6.78 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.573 0.225 . . . . 0.0 110.602 175.693 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.434 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 15.5 mmt180 -47.8 -54.92 10.9 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.535 -170.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.425 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 92.5 m -56.27 -41.09 75.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.069 0.461 . . . . 0.0 111.121 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.612 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -70.5 -25.48 63.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.966 -177.588 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.503 ' HB2' HD13 ' A' ' 40' ' ' LEU . 45.5 t80 -62.2 -42.65 99.49 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 173.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.468 ' O ' ' HG3' ' A' ' 50' ' ' LYS . 36.7 mt-10 -65.56 -49.23 69.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.584 176.233 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.467 ' HA ' ' HD3' ' A' ' 50' ' ' LYS . 42.4 mt-10 -54.66 -48.19 72.64 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.334 -178.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.476 ' C ' ' SD ' ' A' ' 48' ' ' MET . 0.5 OUTLIER -68.33 -51.9 39.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.493 -177.658 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 53.3 tp -61.83 -28.52 69.54 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.923 -176.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 46' ' ' GLU . 9.6 mtpm? -53.68 -50.07 66.62 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.152 0.501 . . . . 0.0 110.42 173.355 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.423 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 7.4 mm-40 -76.14 -44.46 38.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.031 -176.147 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 69.75 22.78 76.95 Favored Glycine 0 C--N 1.333 0.364 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.641 -176.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.428 ' CE1' ' HG2' ' A' ' 48' ' ' MET . 5.7 p90 -75.67 170.81 15.45 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 122.732 0.413 . . . . 0.0 111.2 -175.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -60.72 124.68 21.14 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.932 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.6 p -65.22 110.13 3.87 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -176.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.578 ' O ' ' HG2' ' A' ' 59' ' ' MET . 48.6 Cg_endo -67.52 -26.33 40.39 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.636 2.224 . . . . 0.0 112.088 -176.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.566 HD23 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -61.63 -17.63 56.1 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 120.871 0.367 . . . . 0.0 110.72 -177.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -62.97 -12.32 24.82 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.214 178.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.578 ' HG2' ' O ' ' A' ' 56' ' ' PRO . 26.8 ptm -89.99 -16.41 29.9 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.608 0.242 . . . . 0.0 111.329 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -125.51 127.61 46.7 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 -175.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.2 p . . . . . 0 C--O 1.25 1.117 0 CA-C-O 118.936 -0.554 . . . . 0.0 109.928 -179.297 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.501 ' HG2' ' ND2' ' A' ' 11' ' ' ASN . 36.6 tt0 . . . . . 0 N--CA 1.479 0.984 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.501 ' ND2' ' HG2' ' A' ' 10' ' ' GLU . 55.7 m-80 60.53 91.76 0.05 Allowed 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.172 0.51 . . . . 0.0 110.843 -177.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 26.9 m -113.66 34.19 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.035 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.2 m -68.47 83.53 0.27 Allowed 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.609 -174.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 49.1 tp60 -165.86 93.83 0.56 Allowed 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 175.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -76.93 165.74 24.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.254 -173.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -127.77 139.21 52.81 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 176.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.448 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 27.2 t -72.48 109.34 5.76 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.606 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.65 -15.46 21.66 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.297 1.998 . . . . 0.0 111.353 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.448 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 26.7 mm -63.24 -23.47 33.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.204 -177.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 29.5 p -157.1 12.12 0.23 Allowed 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -179.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 88.2 mt 53.72 69.53 0.7 Allowed 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.326 0.584 . . . . 0.0 110.759 -175.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -146.09 146.06 30.77 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.188 -0.914 . . . . 0.0 108.856 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -67.58 162.57 23.16 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -176.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.7 tt -145.76 146.77 19.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.843 0.354 . . . . 0.0 110.583 -176.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -93.45 144.66 25.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.044 178.468 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 15.4 t -75.59 -18.32 59.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.889 0.376 . . . . 0.0 110.522 178.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.412 ' O ' HG11 ' A' ' 30' ' ' VAL . 9.0 t -63.5 117.67 7.07 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.092 178.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 67.6 ttt-85 -63.7 -31.27 72.39 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.508 -176.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.4 p -60.83 -22.75 27.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -174.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.412 HG11 ' O ' ' A' ' 27' ' ' SER . 7.0 p -106.79 2.53 10.1 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-O 120.888 0.375 . . . . 0.0 111.702 -174.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -138.02 164.84 28.07 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.993 0.425 . . . . 0.0 111.068 -177.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 8.2 t60 -100.41 135.61 41.57 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 174.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 48.8 t -95.21 122.33 46.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.609 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.607 HD13 ' HB2' ' A' ' 38' ' ' HIS . 71.1 mt -72.09 153.2 92.68 Favored Pre-proline 0 C--N 1.325 -0.495 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 173.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -63.49 -17.31 59.45 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.577 2.184 . . . . 0.0 111.746 -178.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.4 t -93.5 7.96 42.55 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.504 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.51 23.7 46.06 Favored Glycine 0 C--N 1.337 0.634 0 CA-C-N 116.257 -0.429 . . . . 0.0 113.668 172.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.607 ' HB2' HD13 ' A' ' 34' ' ' LEU . 43.5 m-70 -103.5 156.99 17.35 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 122.595 -0.356 . . . . 0.0 111.175 178.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 44.4 mt -111.11 142.94 42.62 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.879 177.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.482 HD12 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -160.63 145.3 14.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.821 173.089 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.561 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -58.88 162.27 4.26 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.68 0.276 . . . . 0.0 110.687 176.478 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.474 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 24.4 mmt180 -50.4 -57.12 8.71 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.811 -169.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 24.8 p -59.44 -49.04 79.35 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.39 -177.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.561 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -59.22 -27.95 66.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.56 -176.456 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.482 ' HB2' HD12 ' A' ' 40' ' ' LEU . 31.5 t80 -55.3 -53.64 53.63 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.611 0.72 . . . . 0.0 109.783 174.435 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.474 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 6.4 mm-40 -69.66 -37.66 76.81 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.542 -1.208 . . . . 0.0 110.57 -177.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -62.56 -41.16 98.74 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.53 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 19.5 ttp -75.19 -50.39 16.38 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.026 0.441 . . . . 0.0 110.155 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 48.8 tp -61.55 -28.71 69.53 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.425 -177.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.474 ' HB2' ' O ' ' A' ' 46' ' ' GLU . 22.7 ttmm -57.96 -45.18 87.08 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.076 176.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.9 mm-40 -74.4 -40.81 61.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.158 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 65.19 46.22 88.45 Favored Glycine 0 N--CA 1.451 -0.317 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.374 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 20.8 p90 -104.49 -179.51 3.97 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -64.14 120.17 11.58 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.882 -177.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.6 p -54.59 108.24 1.09 Allowed Pre-proline 0 C--O 1.235 0.315 0 CA-C-O 120.77 0.319 . . . . 0.0 111.845 -178.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.453 ' O ' ' HG2' ' A' ' 59' ' ' MET . 40.6 Cg_endo -65.16 -19.19 62.78 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 122.784 2.323 . . . . 0.0 112.422 -174.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.573 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -71.59 -11.27 60.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.989 0.423 . . . . 0.0 110.323 -179.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -75.37 -22.96 57.11 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.901 173.087 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.453 ' HG2' ' O ' ' A' ' 56' ' ' PRO . 27.3 ptt? -108.77 -22.42 12.23 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.674 0.273 . . . . 0.0 111.061 -178.051 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.486 ' O ' ' HA ' ' A' ' 57' ' ' LEU . 3.9 m80 -142.66 121.99 13.1 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 178.457 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 29.2 t . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.813 -0.613 . . . . 0.0 109.776 -175.234 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 . . . . . 0 N--CA 1.482 1.143 0 CA-C-O 120.853 0.358 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -53.54 113.91 1.34 Allowed 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.383 -174.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 60.2 t -62.58 110.36 0.72 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.259 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.686 177.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 17.4 m -93.09 66.71 4.15 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.625 -176.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.468 ' OE1' ' HA ' ' A' ' 25' ' ' HIS . 8.3 tp-100 -161.21 149.25 15.58 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.619 178.048 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.735 HE22 ' HB2' ' A' ' 39' ' ' LEU . 25.6 tt0 -88.21 167.1 13.87 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 120.954 0.407 . . . . 0.0 110.863 -175.345 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -143.57 161.61 38.03 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.269 179.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.551 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 42.8 t -97.74 111.06 57.89 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.641 -177.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -77.5 -12.34 16.94 Favored 'Trans proline' 0 CA--C 1.534 0.504 0 C-N-CA 122.259 1.973 . . . . 0.0 112.129 175.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.551 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 29.0 mm -59.85 -44.47 94.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-O 120.794 0.331 . . . . 0.0 110.808 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.548 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 27.8 p -132.0 15.72 4.7 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.539 -177.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 51.8 mt 52.41 72.28 0.41 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 121.28 0.562 . . . . 0.0 109.591 -175.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.548 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 21.1 tt0 -146.13 -176.45 5.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.311 -171.458 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.479 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 16.0 t70 -86.82 156.35 19.92 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 122.543 0.337 . . . . 0.0 111.308 178.725 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.551 HG13 ' HB2' ' A' ' 17' ' ' CYS . 8.5 mt -148.87 105.1 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 169.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.468 ' HA ' ' OE1' ' A' ' 14' ' ' GLN . 1.8 p80 -76.1 136.65 39.85 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.535 -0.542 . . . . 0.0 109.535 172.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.7 m -52.81 -17.69 1.5 Allowed 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -171.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.6 m -52.35 106.42 0.15 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 120.857 0.36 . . . . 0.0 111.338 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -62.61 -24.39 67.56 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.111 -178.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.7 t -53.54 -30.67 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-O 121.079 0.466 . . . . 0.0 110.955 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 60.6 t -106.26 -47.09 8.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.452 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.534 ' HB2' ' HB3' ' A' ' 39' ' ' LEU . . . -79.55 107.0 11.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.703 -178.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.575 ' HB2' HH11 ' A' ' 42' ' ' ARG . 9.4 t60 -69.1 134.99 50.08 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.211 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.2 t -87.15 115.2 27.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.249 -178.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.562 HD11 ' HB2' ' A' ' 38' ' ' HIS . 43.0 mt -72.01 147.82 91.37 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.99 170.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -55.61 -24.64 46.18 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.818 2.345 . . . . 0.0 112.498 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.9 t -88.72 5.92 41.06 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.761 -177.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.24 23.66 33.9 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 121.315 -0.469 . . . . 0.0 113.54 173.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.562 ' HB2' HD11 ' A' ' 34' ' ' LEU . 70.3 m-70 -102.89 155.61 18.23 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.9 0.35 . . . . 0.0 111.013 178.026 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.735 ' HB2' HE22 ' A' ' 15' ' ' GLN . 81.1 mt -115.71 136.93 52.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.343 175.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.547 HD12 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -160.26 146.36 15.44 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.747 0.308 . . . . 0.0 111.101 175.222 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.552 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -58.91 157.65 9.51 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.223 178.39 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.575 HH11 ' HB2' ' A' ' 32' ' ' HIS . 26.2 mmt180 -46.57 -58.37 3.87 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.567 -171.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.437 ' O ' ' HG2' ' A' ' 47' ' ' GLU . 28.4 m -57.65 -48.26 79.98 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.003 0.43 . . . . 0.0 110.93 -177.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.552 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -61.01 -28.74 69.26 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.921 -179.214 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.547 ' HB2' HD12 ' A' ' 40' ' ' LEU . 39.6 t80 -65.16 -55.29 19.49 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.501 177.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -61.5 -48.22 82.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.265 -175.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 43' ' ' THR . 48.6 mm-40 -59.69 -45.48 91.95 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -175.804 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 18.9 ttp -65.87 -44.99 83.73 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.029 0.442 . . . . 0.0 110.053 -179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 42.8 tp -68.89 -28.15 66.43 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.766 -179.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.453 ' HE2' ' HB3' ' A' ' 50' ' ' LYS . 4.7 tmmm? -68.45 -33.85 74.92 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.049 179.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -76.98 -56.23 4.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.593 173.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 91.0 14.68 57.44 Favored Glycine 0 C--N 1.332 0.314 0 CA-C-N 115.842 -0.617 . . . . 0.0 113.334 175.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 21.9 p90 -75.38 173.55 10.77 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 117.007 0.404 . . . . 0.0 110.333 177.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 -56.7 128.03 34.42 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.551 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.2 p -54.26 109.62 1.64 Allowed Pre-proline 0 C--O 1.235 0.306 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.546 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.433 ' HG2' HD12 ' A' ' 19' ' ' ILE . 23.9 Cg_endo -60.78 -25.93 82.06 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.729 2.286 . . . . 0.0 112.658 -175.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.555 HD21 ' HB3' ' A' ' 38' ' ' HIS . 3.9 mp -65.46 -15.68 62.88 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 120.902 0.382 . . . . 0.0 110.967 -177.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -73.93 -32.71 63.64 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.581 176.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 83.1 mmm -109.43 -18.36 13.56 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 120.938 0.399 . . . . 0.0 111.365 -175.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.405 ' O ' ' HA ' ' A' ' 57' ' ' LEU . 75.9 m80 -134.09 134.79 42.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.56 -175.111 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 9.9 p . . . . . 0 C--O 1.251 1.146 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.546 176.84 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 . . . . . 0 N--CA 1.479 0.999 0 CA-C-O 120.876 0.369 . . . . 0.0 110.135 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -112.14 40.21 2.24 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.094 0.473 . . . . 0.0 110.833 -177.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 13.8 p -77.24 -30.55 17.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.898 -178.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.0 m -81.4 -17.15 49.94 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.774 -178.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -79.98 122.94 27.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.35 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -62.95 124.83 22.09 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.009 177.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 34.8 p30 -148.44 162.09 40.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.021 0.439 . . . . 0.0 110.391 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.59 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 35.5 t -99.11 109.29 53.72 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.333 -177.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -74.24 -16.56 22.21 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.451 2.101 . . . . 0.0 111.557 175.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.59 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 34.4 mm -61.03 -25.89 37.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.022 -179.048 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 27.6 p -156.7 18.4 0.32 Allowed 'General case' 0 N--CA 1.466 0.349 0 O-C-N 122.41 -0.181 . . . . 0.0 111.335 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 80.2 mt 56.27 39.88 30.07 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.916 0.388 . . . . 0.0 111.507 177.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -118.29 174.33 6.29 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.183 -178.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -67.69 153.51 43.54 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.357 -175.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.483 HD13 ' HA ' ' A' ' 40' ' ' LEU . 1.8 mt -153.87 146.16 14.19 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 CA-C-N 115.287 -0.87 . . . . 0.0 108.986 171.435 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 24.0 m80 -149.25 -170.14 3.55 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 122.328 0.251 . . . . 0.0 110.564 178.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.497 ' O ' ' HD2' ' A' ' 28' ' ' ARG . 51.7 p -62.99 -17.55 62.26 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -173.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.5 m -57.54 99.45 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 111.536 0.199 . . . . 0.0 111.536 -178.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.497 ' HD2' ' O ' ' A' ' 26' ' ' THR . 5.2 mpt_? -71.57 -28.73 64.04 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.191 0.52 . . . . 0.0 110.134 178.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 46.7 t -62.67 -38.14 80.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.079 177.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.531 ' O ' ' HA ' ' A' ' 41' ' ' HIS . 60.9 t -82.32 -62.62 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.85 -0.613 . . . . 0.0 109.658 176.398 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.485 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -85.69 98.72 10.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.491 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -61.98 143.45 56.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.34 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 40.2 t -86.89 115.58 27.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.363 -177.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.604 HD11 ' HB2' ' A' ' 38' ' ' HIS . 32.2 mt -67.39 151.79 96.81 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.812 173.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -59.15 -19.02 47.29 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.87 2.38 . . . . 0.0 111.896 174.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 32.5 t -99.51 18.17 18.55 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.501 -178.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.91 15.19 79.62 Favored Glycine 0 C--N 1.338 0.666 0 N-CA-C 114.706 0.642 . . . . 0.0 114.706 169.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.604 ' HB2' HD11 ' A' ' 34' ' ' LEU . 36.3 m-70 -103.0 157.39 17.01 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 117.58 0.69 . . . . 0.0 111.041 178.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.485 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 97.6 mt -108.57 138.54 44.71 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.849 177.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.521 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -158.91 138.9 12.04 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 122.83 0.452 . . . . 0.0 110.482 174.125 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.531 ' HA ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -56.46 163.5 1.72 Allowed 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.674 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 18.6 mmt180 -43.15 -64.72 0.58 Allowed 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 114.884 -1.053 . . . . 0.0 112.551 -173.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 24.3 p -56.56 -47.47 79.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.114 0.483 . . . . 0.0 110.923 -177.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.496 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.5 OUTLIER -61.98 -28.75 69.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.232 -179.671 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.521 ' HB2' HD13 ' A' ' 40' ' ' LEU . 53.5 t80 -68.63 -53.14 24.42 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.047 0.451 . . . . 0.0 110.034 176.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -62.28 -45.07 94.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.741 -177.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.1 mm-40 -59.85 -54.52 45.28 Favored 'General case' 0 C--O 1.234 0.261 0 O-C-N 123.129 0.268 . . . . 0.0 111.609 178.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.463 ' HA ' ' CE1' ' A' ' 53' ' ' TYR . 6.8 ttp -58.94 -40.79 85.72 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.131 0.491 . . . . 0.0 110.175 -176.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.1 tp -75.85 -29.91 58.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.875 -178.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 50.1 tttm -65.51 -51.11 62.34 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.257 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -71.24 -31.45 67.56 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.932 174.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 62.38 38.59 96.52 Favored Glycine 0 N--CA 1.452 -0.28 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.458 177.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.463 ' CE1' ' HA ' ' A' ' 48' ' ' MET . 41.1 p90 -88.12 -175.95 5.24 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.786 0.327 . . . . 0.0 110.634 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.792 ' H ' ' HD2' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -75.22 144.77 42.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.355 -173.951 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.5 p -84.27 107.09 9.69 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.805 -178.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -67.23 -13.52 39.82 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 122.516 2.144 . . . . 0.0 111.811 179.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.571 HD21 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -74.99 -6.75 51.02 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.44 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -73.5 -24.8 60.22 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 173.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.445 ' C ' ' SD ' ' A' ' 59' ' ' MET . 0.8 OUTLIER -87.33 -47.79 8.52 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.522 174.212 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 76.7 t60 -105.07 102.73 12.21 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.009 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 70.7 m . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.907 -0.568 . . . . 0.0 109.807 176.055 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 . . . . . 0 N--CA 1.481 1.093 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -101.95 116.72 33.32 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.8 t -102.4 -47.85 10.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.958 0.408 . . . . 0.0 110.679 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.1 t -88.91 5.16 45.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.366 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -136.09 146.18 46.74 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.527 HE22 HG23 ' A' ' 26' ' ' THR . 1.7 mp0 -88.65 153.79 20.83 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 121.055 0.455 . . . . 0.0 110.351 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -124.07 150.24 45.21 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.981 175.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.511 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 10.6 t -90.38 108.99 30.54 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.805 -176.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -68.96 -11.37 31.66 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.256 1.971 . . . . 0.0 112.041 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.511 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 26.5 mm -71.87 -21.1 20.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.875 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.417 ' SG ' ' CG ' ' A' ' 22' ' ' GLU . 21.8 p -164.12 17.49 0.06 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 120.944 -0.303 . . . . 0.0 111.776 -179.483 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.419 ' N ' ' O ' ' A' ' 17' ' ' CYS . 60.1 mt 53.67 31.08 12.06 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.417 ' CG ' ' SG ' ' A' ' 20' ' ' CYS . 56.4 mm-40 -101.97 -177.59 3.46 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.23 178.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -74.75 148.4 40.47 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -174.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.493 HD13 ' HA ' ' A' ' 40' ' ' LEU . 4.5 mt -149.72 124.0 1.68 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 C-N-CA 123.38 0.672 . . . . 0.0 109.924 170.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 18.1 t-80 -108.5 157.82 18.1 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 177.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.527 HG23 HE22 ' A' ' 15' ' ' GLN . 13.3 p -54.06 -22.48 10.87 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -179.67 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 9.6 m -61.94 100.51 0.16 Allowed 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.018 0.437 . . . . 0.0 110.555 177.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.9 ppt_? -81.18 16.81 1.43 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.532 -176.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 56.4 t -71.21 -47.63 59.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 172.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.411 ' O ' ' HA ' ' A' ' 41' ' ' HIS . 7.8 p -86.1 -38.4 12.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.199 175.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.478 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -86.76 101.86 13.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.67 -179.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -59.52 137.14 58.11 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.362 178.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 30.6 t -86.25 108.81 18.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.593 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.586 HD13 ' HB2' ' A' ' 38' ' ' HIS . 43.2 mt -66.9 151.04 97.4 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.286 173.519 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.4 -24.59 69.42 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.726 2.284 . . . . 0.0 112.237 179.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 43.0 t -91.13 7.73 39.15 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.65 -177.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.98 22.54 45.11 Favored Glycine 0 C--N 1.337 0.588 0 CA-C-N 116.103 -0.499 . . . . 0.0 113.872 172.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.586 ' HB2' HD13 ' A' ' 34' ' ' LEU . 78.0 m-70 -101.64 155.94 17.8 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 117.263 0.531 . . . . 0.0 110.784 177.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.478 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 71.0 mt -115.75 136.38 53.11 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.558 177.066 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.493 ' HA ' HD13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -161.19 140.31 10.19 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.005 175.368 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.585 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -53.65 153.09 4.62 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.604 0.24 . . . . 0.0 111.518 179.354 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.47 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 15.3 mmt180 -44.24 -57.04 3.69 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.941 0.897 . . . . 0.0 112.203 -172.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.455 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 61.1 m -52.7 -49.35 65.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.04 -178.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.585 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -65.1 -30.87 71.85 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.029 -177.914 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.491 ' HB2' HD12 ' A' ' 40' ' ' LEU . 13.3 t80 -60.88 -50.31 73.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.98 175.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.473 ' O ' ' HG3' ' A' ' 50' ' ' LYS . 47.6 mt-10 -64.87 -41.43 95.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.592 -179.239 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 43' ' ' THR . 43.8 mt-10 -55.65 -55.36 33.05 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.998 0.428 . . . . 0.0 110.835 177.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 15.6 ttp -65.49 -40.92 93.63 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.918 -175.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 34.9 tp -73.84 -28.76 61.76 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.552 -173.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.473 ' HG3' ' O ' ' A' ' 46' ' ' GLU . 56.5 mttp -57.26 -47.73 80.68 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.104 0.478 . . . . 0.0 110.049 175.504 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -70.27 -39.18 75.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.61 173.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 64.63 19.76 65.3 Favored Glycine 0 N--CA 1.45 -0.416 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.257 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.2 p90 -70.75 173.94 6.62 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 120.761 0.315 . . . . 0.0 110.651 -177.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 67.9 mtt180 -65.04 122.9 18.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.532 -175.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.4 p -54.12 112.46 3.88 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.772 -173.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -63.73 -24.86 68.68 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.73 2.287 . . . . 0.0 112.332 -178.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.558 HD21 ' HB3' ' A' ' 38' ' ' HIS . 4.6 mp -66.65 -14.42 62.44 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 120.762 0.315 . . . . 0.0 110.823 -178.158 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -75.36 -28.82 59.69 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.976 174.113 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.425 ' HG3' ' HD2' ' A' ' 60' ' ' HIS . 23.8 ptp -109.78 -14.02 14.38 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 -175.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.425 ' HD2' ' HG3' ' A' ' 59' ' ' MET . 62.4 m-70 -147.02 166.56 26.45 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 122.512 0.325 . . . . 0.0 110.149 178.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 40.9 m . . . . . 0 C--O 1.253 1.242 0 CA-C-O 119.011 -0.519 . . . . 0.0 109.647 178.813 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 . . . . . 0 N--CA 1.482 1.128 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -161.35 145.88 13.38 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.101 -178.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 27.6 m -65.51 -27.36 41.48 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.199 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.3 p -108.01 156.23 19.46 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.307 177.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.454 ' NE2' HG21 ' A' ' 26' ' ' THR . 28.7 tt0 -66.08 -57.07 8.53 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.8 mp0 -123.89 141.15 52.29 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 168.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -101.43 135.88 42.2 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.226 0.536 . . . . 0.0 110.568 -177.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.539 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 11.1 t -82.37 108.45 11.86 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.63 177.193 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.85 -11.52 29.53 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.171 1.914 . . . . 0.0 111.539 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.539 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 21.0 mm -69.5 -25.81 29.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.684 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.791 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 17.4 p -165.21 22.77 0.05 Allowed 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -177.025 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 90.9 mt 59.03 24.71 12.99 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 176.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.791 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 0.3 OUTLIER -97.33 171.21 8.56 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 -177.515 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -76.34 150.75 36.84 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.977 0.417 . . . . 0.0 111.239 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.458 HD12 ' O ' ' A' ' 39' ' ' LEU . 7.4 mt -144.12 121.9 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.261 172.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 -105.05 159.71 15.61 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.933 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.526 ' O ' ' HD3' ' A' ' 28' ' ' ARG . 0.9 OUTLIER -59.33 -17.5 29.99 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -177.714 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.3 m -59.63 104.89 0.31 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.631 -0.259 . . . . 0.0 111.687 -177.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.526 ' HD3' ' O ' ' A' ' 26' ' ' THR . 1.7 mpp_? -66.88 -14.61 62.93 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.776 0.322 . . . . 0.0 110.683 176.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 58.4 t -69.99 -33.22 54.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.554 176.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 59.2 t -98.24 -50.58 11.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.275 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.468 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -93.09 113.29 25.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.254 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -62.16 128.29 35.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.739 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.4 ' HA ' HD23 ' A' ' 39' ' ' LEU . 7.2 p -83.66 121.52 36.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.269 0.557 . . . . 0.0 111.337 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.598 HD12 ' HB2' ' A' ' 38' ' ' HIS . 94.9 mt -73.05 154.34 90.72 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.647 174.692 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -62.64 -9.99 17.96 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.779 2.319 . . . . 0.0 112.251 178.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.8 t -107.23 17.46 22.88 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.207 0.527 . . . . 0.0 109.847 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.56 -14.89 63.75 Favored Glycine 0 C--N 1.341 0.84 0 N-CA-C 114.966 0.746 . . . . 0.0 114.966 168.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.598 ' HB2' HD12 ' A' ' 34' ' ' LEU . 14.2 m-70 -81.78 156.7 24.8 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 117.572 0.686 . . . . 0.0 111.385 -173.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.468 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 97.5 mt -109.65 145.27 36.77 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.282 177.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.501 HD11 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -157.96 152.43 24.73 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 174.047 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.459 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -70.59 171.81 9.64 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.76 0.314 . . . . 0.0 111.379 -179.577 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.461 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 12.3 mmm180 -46.48 -67.25 0.3 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.775 -173.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 22.3 m -60.71 -43.86 97.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.06 0.457 . . . . 0.0 110.681 -175.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.459 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.6 OUTLIER -63.68 -23.94 67.58 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.586 -176.27 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.501 ' HB2' HD11 ' A' ' 40' ' ' LEU . 34.4 t80 -61.4 -50.3 73.42 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 173.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -67.67 -41.21 84.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.721 -179.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -56.62 -51.03 70.23 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.489 -177.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.415 ' HE3' HD11 ' A' ' 34' ' ' LEU . 13.6 ttp -70.18 -49.52 49.55 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.933 0.397 . . . . 0.0 110.656 -177.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.4 tp -62.2 -34.77 77.1 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.913 -176.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -55.06 -48.04 74.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.286 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -68.9 -43.9 74.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.208 177.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.78 18.89 79.42 Favored Glycine 0 CA--C 1.519 0.287 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.861 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.431 ' CE2' ' HD3' ' A' ' 56' ' ' PRO . 13.7 p90 -79.06 176.9 9.23 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 178.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 79.2 mtp180 -62.41 119.47 9.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.613 0.244 . . . . 0.0 110.353 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 0.5 OUTLIER -51.37 113.87 4.41 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.51 178.426 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.431 ' HD3' ' CE2' ' A' ' 53' ' ' TYR . 35.0 Cg_endo -63.78 -17.59 60.51 Favored 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 122.519 2.146 . . . . 0.0 111.534 -178.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.45 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.8 mp -75.92 -2.66 31.35 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.143 179.074 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.49 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.5 OUTLIER -74.2 -16.1 60.99 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 171.461 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 62.7 mtm -105.8 -4.9 20.3 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.225 175.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -144.0 95.86 2.8 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.054 179.097 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 32.3 t . . . . . 0 C--O 1.25 1.122 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.128 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.407 ' OE1' HG22 ' A' ' 12' ' ' VAL . 0.3 OUTLIER . . . . . 0 N--CA 1.484 1.273 0 CA-C-O 120.797 0.332 . . . . 0.0 111.016 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -160.16 66.7 0.35 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.437 0.637 . . . . 0.0 109.309 174.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.407 HG22 ' OE1' ' A' ' 10' ' ' GLU . 25.7 m -85.42 71.69 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.623 0.725 . . . . 0.0 111.304 -178.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.1 t -82.24 86.39 6.67 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 175.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -136.51 113.04 10.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.382 -175.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.625 ' O ' ' HB ' ' A' ' 24' ' ' ILE . 85.3 mm-40 -90.87 81.87 5.7 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 176.589 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.537 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 32.6 m-80 -60.99 139.45 58.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.723 -174.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.554 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 12.8 t -71.2 110.23 6.93 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.518 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.537 ' HD3' ' O ' ' A' ' 16' ' ' ASN . 5.0 Cg_exo -75.06 -13.44 21.28 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.547 2.164 . . . . 0.0 110.864 174.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.554 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 11.9 mm -66.0 -27.0 39.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.856 -176.522 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.444 ' SG ' ' OE2' ' A' ' 22' ' ' GLU . 18.3 p -165.15 20.41 0.05 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 111.672 0.249 . . . . 0.0 111.672 -178.664 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 90.8 mt 55.73 89.65 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.81 0.338 . . . . 0.0 111.186 -177.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.444 ' OE2' ' SG ' ' A' ' 20' ' ' CYS . 26.6 mt-10 -157.09 171.86 19.7 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.651 -179.571 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -83.3 145.62 28.99 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.996 175.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.625 ' HB ' ' O ' ' A' ' 15' ' ' GLN . 34.2 mt -138.75 111.73 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.34 173.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -80.35 150.92 29.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.683 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 16.3 p -57.74 -17.87 17.96 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -177.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.4 m -66.3 97.21 0.39 Allowed 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.735 0.302 . . . . 0.0 110.934 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.561 ' HD3' ' H ' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -78.09 11.41 2.31 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.101 0.477 . . . . 0.0 111.344 -179.046 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 37.4 t -74.39 -45.36 46.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 172.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.6 p -87.58 -44.81 16.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.052 178.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.85 112.89 18.65 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.233 -0.439 . . . . 0.0 109.946 177.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.409 ' O ' HD11 ' A' ' 40' ' ' LEU . 19.2 t60 -61.08 131.02 49.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.298 -178.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.418 ' HA ' HD21 ' A' ' 39' ' ' LEU . 7.3 p -86.36 120.61 36.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.017 179.226 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.58 HD11 ' HB2' ' A' ' 38' ' ' HIS . 76.2 mt -74.86 153.37 86.96 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.074 173.26 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.5 -18.13 58.91 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.295 1.996 . . . . 0.0 111.674 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 37.0 t -90.76 9.03 31.67 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.328 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.18 19.21 57.79 Favored Glycine 0 C--N 1.338 0.666 0 CA-C-N 116.112 -0.495 . . . . 0.0 114.127 171.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.58 ' HB2' HD11 ' A' ' 34' ' ' LEU . 61.2 m-70 -104.18 157.15 17.32 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 117.4 0.6 . . . . 0.0 111.1 177.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.418 HD21 ' HA ' ' A' ' 33' ' ' VAL . 93.5 mt -113.52 143.93 43.7 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.358 175.32 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.528 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -159.18 148.02 18.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.477 175.615 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.558 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.1 OUTLIER -58.25 151.76 18.71 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.446 175.858 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.46 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 17.5 mmt85 -47.84 -57.44 5.64 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.842 0.714 . . . . 0.0 112.092 -170.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.437 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 20.2 m -53.63 -40.43 65.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.171 0.51 . . . . 0.0 111.387 -178.289 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.558 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -72.14 -25.35 61.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.999 -176.058 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.528 ' HB2' HD13 ' A' ' 40' ' ' LEU . 20.5 t80 -61.2 -46.64 89.62 Favored 'General case' 0 C--O 1.232 0.143 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 173.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.73 -51.0 71.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.288 176.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 43' ' ' THR . 42.4 mt-10 -54.65 -55.87 25.03 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.615 -177.085 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 10.1 ttp -63.35 -44.95 93.38 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.777 -175.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 64.9 tp -64.09 -34.02 77.09 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.649 -177.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.689 ' HZ2' ' HB3' ' A' ' 50' ' ' LYS . 8.8 mtpm? -67.86 -50.23 57.65 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.972 0.415 . . . . 0.0 110.658 176.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -63.61 -29.35 70.61 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.85 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 60.93 23.71 61.79 Favored Glycine 0 C--N 1.332 0.319 0 CA-C-N 115.829 -0.623 . . . . 0.0 113.328 174.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -85.8 169.21 13.58 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 110.333 -0.247 . . . . 0.0 110.333 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 38.0 mmt180 -58.1 127.22 30.99 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.709 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 1.2 p -60.79 106.33 0.76 Allowed Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.214 178.285 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -65.93 -18.08 56.75 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.714 2.276 . . . . 0.0 112.272 -174.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.559 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.7 mp -68.76 -17.3 64.02 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.153 178.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.7 OUTLIER -66.18 -17.37 64.68 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.991 0.425 . . . . 0.0 110.422 174.23 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 27.3 ttt -89.18 -11.17 44.52 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.401 177.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 -128.11 99.23 5.39 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.781 -178.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.8 p . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.787 -0.625 . . . . 0.0 109.679 175.7 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.481 1.124 0 CA-C-O 121.222 0.534 . . . . 0.0 111.387 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 -157.14 129.46 7.37 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.057 168.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.7 t -73.41 109.77 6.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.982 -175.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.1 p -81.17 -33.17 33.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.577 177.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -66.16 104.92 1.26 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.638 178.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.464 ' HB3' HG21 ' A' ' 24' ' ' ILE . 6.4 tp-100 -77.25 145.97 37.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.112 -173.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -106.65 142.62 36.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.112 0.482 . . . . 0.0 109.865 174.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.453 ' HB2' HG13 ' A' ' 24' ' ' ILE . 33.3 t -85.98 111.09 35.67 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.793 -178.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.492 ' HG2' ' HG ' ' A' ' 57' ' ' LEU . 17.2 Cg_exo -64.91 -19.01 63.9 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.353 2.036 . . . . 0.0 111.398 179.268 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.476 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 11.7 mm -76.65 -12.41 14.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.812 -173.328 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.457 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 20.2 p -171.68 19.36 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 77.9 mt 60.08 16.35 5.86 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 176.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.457 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 27.6 mm-40 -97.0 173.28 7.36 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.564 0.221 . . . . 0.0 111.105 -177.016 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -69.83 153.52 43.2 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 116.172 -0.467 . . . . 0.0 112.087 -175.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.464 HG21 ' HB3' ' A' ' 15' ' ' GLN . 4.3 mt -150.32 131.53 4.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 123.558 0.743 . . . . 0.0 109.431 172.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 52.3 m80 -114.46 168.85 9.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.83 177.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 14.5 t -70.23 -17.2 63.13 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.656 -175.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.7 p -69.32 133.12 47.46 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.644 177.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.63 ' HD2' ' H ' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -97.74 11.14 38.17 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.383 -176.915 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 64.0 t -58.67 -50.05 80.49 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-O 120.954 0.407 . . . . 0.0 110.289 178.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 49.4 t -100.95 -32.77 3.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.073 177.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.573 ' HA ' ' HA ' ' A' ' 41' ' ' HIS . . . -86.72 104.54 16.21 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.285 -178.293 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.2 t60 -65.21 131.53 46.75 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.3 p -89.56 115.46 29.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.025 0.441 . . . . 0.0 110.743 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.606 HD11 ' HB2' ' A' ' 38' ' ' HIS . 86.6 mt -64.5 153.41 86.94 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.086 175.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -67.26 -10.59 29.15 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.27 1.98 . . . . 0.0 111.364 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 38.6 t -97.03 9.67 41.43 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.386 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.95 17.38 59.64 Favored Glycine 0 C--N 1.338 0.68 0 N-CA-C 114.33 0.492 . . . . 0.0 114.33 171.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.606 ' HB2' HD11 ' A' ' 34' ' ' LEU . 25.4 m-70 -103.84 156.08 18.11 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 117.499 0.649 . . . . 0.0 110.945 178.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 71.5 mt -112.9 135.92 53.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.946 0.403 . . . . 0.0 110.95 176.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.488 HD21 HD12 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -155.09 137.0 14.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.11 173.654 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.573 ' HA ' ' HA ' ' A' ' 31' ' ' ALA . 0.0 OUTLIER -58.0 163.48 2.75 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.884 0.374 . . . . 0.0 111.934 -177.952 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.436 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 16.1 mmm180 -37.59 -69.01 0.13 Allowed 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 114.463 -1.244 . . . . 0.0 113.204 -174.301 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 53.3 m -63.22 -35.74 81.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.005 0.431 . . . . 0.0 111.292 -174.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.501 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -68.45 -24.05 64.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.175 -177.284 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.436 ' HB3' ' O ' ' A' ' 42' ' ' ARG . 30.1 t80 -60.82 -43.71 97.86 Favored 'General case' 0 C--O 1.232 0.179 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 173.191 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.434 ' HB3' ' HE2' ' A' ' 50' ' ' LYS . 41.6 mt-10 -64.43 -48.46 75.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.091 177.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.554 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 43.6 mt-10 -54.04 -57.01 12.65 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.501 -176.184 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 11.4 ttp -63.96 -47.72 79.31 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.064 0.459 . . . . 0.0 110.574 -175.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.0 tp -61.73 -38.16 86.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.284 -175.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.434 ' HE2' ' HB3' ' A' ' 46' ' ' GLU . 68.9 mttm -71.25 -35.37 71.4 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.57 0.224 . . . . 0.0 111.017 -179.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.554 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 8.1 mm-40 -59.52 -31.59 69.53 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.004 0.43 . . . . 0.0 110.487 178.053 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.59 -4.34 60.55 Favored Glycine 0 CA--C 1.518 0.261 0 CA-C-N 115.797 -0.638 . . . . 0.0 114.065 171.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -73.12 166.75 22.51 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 117.677 0.738 . . . . 0.0 110.723 179.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 63.3 mtm180 -65.44 135.62 55.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.246 -0.434 . . . . 0.0 109.89 177.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.458 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 0.9 OUTLIER -54.14 109.72 1.69 Allowed Pre-proline 0 C--N 1.327 -0.37 0 O-C-N 123.304 0.377 . . . . 0.0 112.01 -178.195 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -66.49 -17.62 53.56 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.64 2.226 . . . . 0.0 111.877 -178.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.546 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -70.82 -8.71 54.49 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.177 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.458 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.5 OUTLIER -70.81 -22.09 62.39 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.292 0.568 . . . . 0.0 109.85 174.245 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.567 ' SD ' ' N ' ' A' ' 59' ' ' MET . 1.1 mpt? -105.93 8.77 32.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.019 179.18 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -157.75 96.92 1.53 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.952 -174.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 71.1 m . . . . . 0 C--O 1.247 0.969 0 CA-C-O 118.599 -0.715 . . . . 0.0 109.779 176.836 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 . . . . . 0 N--CA 1.48 1.071 0 CA-C-O 120.693 0.282 . . . . 0.0 110.38 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -177.26 126.58 0.15 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.738 179.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 65.2 t -76.7 89.39 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.1 0.476 . . . . 0.0 110.554 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 65.1 p -168.21 118.71 0.79 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.744 177.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 23.7 mp0 -64.08 -43.22 96.06 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 178.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 67.0 mm-40 -141.84 164.03 31.29 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.257 174.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 -136.61 150.5 48.58 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.256 -0.429 . . . . 0.0 109.995 -179.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.617 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 13.4 t -96.78 110.52 53.82 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.134 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -68.63 -20.82 40.22 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.188 1.925 . . . . 0.0 111.097 175.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.617 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 19.3 mm -63.67 -25.51 38.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.241 -177.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.48 ' SG ' ' CG ' ' A' ' 22' ' ' GLU . 18.7 p -166.42 25.41 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.709 0.29 . . . . 0.0 111.597 -179.336 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 61.1 mt 54.78 21.96 3.88 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 112.867 0.692 . . . . 0.0 112.867 176.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.48 ' CG ' ' SG ' ' A' ' 20' ' ' CYS . 35.5 mm-40 -93.17 162.58 13.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.732 0.301 . . . . 0.0 110.962 -178.32 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -62.94 151.67 38.78 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.801 -179.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.2 mt -148.6 124.13 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.41 173.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -105.07 172.03 7.01 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 110.083 -0.339 . . . . 0.0 110.083 175.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.4 m -71.32 -18.75 62.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.724 -174.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.472 ' OG ' HG11 ' A' ' 29' ' ' VAL . 20.6 t -58.23 106.81 0.41 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 120.961 0.41 . . . . 0.0 110.87 -179.45 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.5 8.21 17.27 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.212 -175.407 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.472 HG11 ' OG ' ' A' ' 27' ' ' SER . 14.6 p -81.94 -38.95 16.21 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-O 121.006 0.432 . . . . 0.0 109.836 174.701 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.4 p -94.22 -44.46 13.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.013 177.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -87.47 97.9 11.09 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 175.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 8.8 t60 -58.49 127.36 31.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.498 -176.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.1 p -81.97 114.31 22.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.134 0.493 . . . . 0.0 110.736 179.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.596 HD13 ' HB2' ' A' ' 38' ' ' HIS . 76.8 mt -65.17 152.8 90.79 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.147 174.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.44 -3.65 12.24 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.348 2.032 . . . . 0.0 111.287 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 36.1 t -105.49 10.11 33.32 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.278 178.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 87.57 16.01 60.89 Favored Glycine 0 C--N 1.339 0.706 0 N-CA-C 114.92 0.728 . . . . 0.0 114.92 170.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.596 ' HB2' HD13 ' A' ' 34' ' ' LEU . 43.8 m-70 -104.3 156.5 17.86 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 117.759 0.779 . . . . 0.0 110.84 177.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 95.4 mt -113.3 137.19 51.86 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 122.533 0.333 . . . . 0.0 110.717 177.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.513 HD12 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -156.24 141.05 17.1 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.251 174.326 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.54 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -55.72 159.34 3.08 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.915 0.388 . . . . 0.0 111.701 179.71 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.502 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 21.5 mmt85 -42.4 -66.07 0.4 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 114.856 -1.065 . . . . 0.0 112.999 -172.217 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 25.2 m -61.67 -37.91 85.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.913 0.387 . . . . 0.0 111.056 -174.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.54 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -66.72 -26.83 67.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.945 179.852 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.513 ' HB2' HD12 ' A' ' 40' ' ' LEU . 38.2 t80 -63.7 -48.61 76.39 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 174.071 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -61.74 -43.78 98.19 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.171 179.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.552 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 79.2 mm-40 -57.93 -56.58 20.16 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.844 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 8.5 ttp -61.52 -44.56 96.84 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.097 0.475 . . . . 0.0 110.411 -175.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 49.2 tp -66.39 -32.02 73.15 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.297 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.3 ttpp -68.64 -42.91 77.33 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.56 177.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.552 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 30.2 mm-40 -65.58 -37.81 87.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.836 177.522 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 64.8 39.09 96.35 Favored Glycine 0 C--N 1.333 0.379 0 CA-C-N 115.589 -0.732 . . . . 0.0 113.132 176.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 6.3 p90 -106.62 177.46 4.85 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.645 0.259 . . . . 0.0 110.693 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 34.6 mmt180 -64.39 119.18 9.87 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.004 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.452 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 0.8 OUTLIER -55.63 107.83 1.0 Allowed Pre-proline 0 CA--C 1.532 0.26 0 O-C-N 123.333 0.396 . . . . 0.0 111.513 -179.169 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -63.8 -21.18 69.41 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 122.697 2.265 . . . . 0.0 111.829 -175.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.568 HD21 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -69.48 -11.3 60.71 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.434 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.452 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.1 OUTLIER -68.18 -19.07 64.75 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.159 0.504 . . . . 0.0 110.211 176.353 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 86.6 mtp -102.88 20.07 18.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.687 176.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 74.3 t60 -139.62 135.87 33.76 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.016 -176.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.0 m . . . . . 0 C--O 1.249 1.043 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.139 175.688 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 . . . . . 0 N--CA 1.481 1.098 0 CA-C-O 120.867 0.365 . . . . 0.0 110.574 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 39.7 t-20 -148.9 136.64 20.53 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 65.7 t -61.29 109.55 0.54 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-O 120.831 0.348 . . . . 0.0 110.748 -178.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.0 p -162.94 146.76 11.14 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.244 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -73.83 -65.28 0.85 Allowed 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 176.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -117.82 149.2 41.21 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 174.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -98.54 140.16 33.2 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.924 0.392 . . . . 0.0 110.082 -178.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.538 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 39.1 t -91.07 108.1 25.81 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.183 174.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -72.68 -12.55 26.76 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.206 1.937 . . . . 0.0 111.189 176.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.538 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 14.3 mm -71.34 -15.18 18.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.988 -178.427 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.427 ' SG ' ' CG ' ' A' ' 22' ' ' GLU . 18.0 p -173.55 22.49 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 179.413 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 88.1 mt 58.73 24.66 12.49 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 176.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.427 ' CG ' ' SG ' ' A' ' 20' ' ' CYS . 42.9 mm-40 -99.15 159.92 14.64 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.668 0.271 . . . . 0.0 111.43 -177.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.25 148.27 52.08 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.206 177.3 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.481 HD13 ' O ' ' A' ' 39' ' ' LEU . 7.4 mt -138.44 120.8 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-O 121.087 0.47 . . . . 0.0 110.558 174.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 23.2 m80 -99.18 175.22 5.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.983 174.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 49.3 p -75.29 -39.65 59.46 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -173.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 35.5 t -45.32 117.85 1.53 Allowed 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.459 0.474 . . . . 0.0 112.202 -173.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.48 ' HA ' ' O ' ' A' ' 31' ' ' ALA . 0.0 OUTLIER -60.51 -20.83 61.43 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.053 179.463 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.2 t -57.55 -47.92 84.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-O 120.988 0.423 . . . . 0.0 110.397 179.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.515 ' O ' ' HA ' ' A' ' 41' ' ' HIS . 60.0 t -91.32 -50.59 12.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.324 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.5 ' HB3' ' HB3' ' A' ' 39' ' ' LEU . . . -99.79 102.78 14.31 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.06 -177.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.6 t60 -66.45 138.65 57.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.755 176.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 8.6 p -90.73 122.32 41.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-O 121.293 0.568 . . . . 0.0 111.254 -178.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.612 HD13 ' HB2' ' A' ' 38' ' ' HIS . 70.1 mt -72.28 154.56 92.0 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.615 174.324 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -58.03 -24.18 64.31 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 122.621 2.214 . . . . 0.0 112.201 177.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 48.0 t -89.72 9.03 28.71 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.575 -178.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.74 22.43 53.3 Favored Glycine 0 C--N 1.337 0.594 0 C-N-CA 121.415 -0.422 . . . . 0.0 113.665 173.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.612 ' HB2' HD13 ' A' ' 34' ' ' LEU . 71.4 m-70 -101.37 157.26 16.93 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 122.449 -0.442 . . . . 0.0 110.95 177.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.5 ' HB3' ' HB3' ' A' ' 31' ' ' ALA . 95.1 mt -112.56 137.38 50.87 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.982 174.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.516 HD11 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -154.28 142.83 20.73 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 174.205 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.515 ' HA ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -62.94 159.86 16.03 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.778 0.323 . . . . 0.0 111.576 -179.88 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.517 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 24.9 mmm180 -37.39 -67.64 0.18 Allowed 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 114.772 -1.104 . . . . 0.0 113.378 -174.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 89.4 m -60.95 -42.46 98.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.929 0.395 . . . . 0.0 111.154 -175.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.503 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -63.28 -25.73 68.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.078 -177.514 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.517 ' HB3' ' O ' ' A' ' 42' ' ' ARG . 44.3 t80 -60.13 -47.02 87.66 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 174.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -67.23 -42.73 83.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.183 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -54.93 -55.28 32.4 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.291 -178.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 15.5 ttp -68.64 -48.09 64.94 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.72 -175.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 39.2 tp -64.82 -28.95 69.91 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.858 -176.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -62.67 -43.31 99.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.263 0.554 . . . . 0.0 110.107 177.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -75.61 -38.45 59.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.713 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 67.32 28.4 73.67 Favored Glycine 0 CA--C 1.519 0.314 0 CA-C-N 115.857 -0.611 . . . . 0.0 112.776 178.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 17.1 p90 -85.11 176.89 8.12 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.407 ' O ' ' HD3' ' A' ' 56' ' ' PRO . 19.7 ptp180 -59.17 136.29 57.91 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 -179.331 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.5 p -72.62 107.15 2.73 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-O 120.615 0.245 . . . . 0.0 111.57 -177.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.407 ' HD3' ' O ' ' A' ' 54' ' ' ARG . 48.7 Cg_endo -67.45 -18.47 49.36 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.585 2.19 . . . . 0.0 111.927 -176.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.543 HD23 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -69.78 -15.67 63.16 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.553 -179.447 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.84 -30.63 71.64 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.984 0.421 . . . . 0.0 110.197 176.011 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.529 ' HG3' ' CD2' ' A' ' 60' ' ' HIS . 23.5 ptp -110.04 -2.83 16.81 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.334 -178.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.529 ' CD2' ' HG3' ' A' ' 59' ' ' MET . 91.1 m-70 -143.11 118.18 10.07 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.613 0.244 . . . . 0.0 110.745 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 55.7 m . . . . . 0 C--O 1.254 1.325 0 CA-C-O 118.407 -0.806 . . . . 0.0 109.647 177.307 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 . . . . . 0 N--CA 1.484 1.236 0 CA-C-O 120.537 0.208 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -138.24 91.38 2.55 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.4 0.619 . . . . 0.0 110.803 -177.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.9 m -115.49 79.15 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.157 176.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.3 m -67.18 -31.88 72.6 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.082 -177.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -71.47 88.67 0.92 Allowed 'General case' 0 C--O 1.237 0.403 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 173.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -61.56 150.71 35.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.733 -169.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -96.34 151.94 19.06 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.4 174.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.417 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 40.7 t -96.76 107.64 38.11 Favored Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 110.224 -0.287 . . . . 0.0 110.224 177.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.15 -16.01 28.61 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.165 1.91 . . . . 0.0 111.447 178.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.417 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 17.2 mm -64.01 -27.2 42.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.746 -179.189 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.441 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 23.3 p -157.57 16.96 0.26 Allowed 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.345 -178.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 88.9 mt 55.89 29.26 13.84 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.053 0.541 . . . . 0.0 112.351 178.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.441 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 35.2 mm-40 -105.98 174.88 5.69 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.152 0.501 . . . . 0.0 111.933 -178.141 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -71.84 148.51 46.12 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.099 -0.955 . . . . 0.0 112.48 -174.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.2 mt -149.19 149.1 15.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 123.695 0.798 . . . . 0.0 109.04 174.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 45.1 m-70 -120.93 150.1 41.61 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 110.0 -0.371 . . . . 0.0 110.0 179.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.6 m -63.52 -17.4 62.75 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.25 -0.432 . . . . 0.0 112.078 -174.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.4 m -66.21 111.4 3.43 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.931 0.396 . . . . 0.0 110.932 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.452 ' HG2' HD23 ' A' ' 39' ' ' LEU . 64.8 mtm180 -72.82 -9.4 58.63 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.291 -176.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.9 p -71.32 -32.5 47.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.234 178.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.4 p -94.13 -36.35 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 CA-C-O 120.764 0.316 . . . . 0.0 111.227 -177.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -101.69 144.25 30.63 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.579 -178.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -72.31 131.77 43.13 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.3 p -93.46 124.55 45.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.065 0.459 . . . . 0.0 111.662 -175.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.595 HD11 ' HB2' ' A' ' 38' ' ' HIS . 55.0 mt -81.23 152.84 71.37 Favored Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.624 173.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -71.59 -2.59 11.58 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.734 2.289 . . . . 0.0 112.096 -178.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 46.6 t -104.04 9.27 36.54 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.068 176.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.3 23.14 49.24 Favored Glycine 0 C--N 1.336 0.563 0 CA-C-N 116.073 -0.512 . . . . 0.0 113.445 172.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.595 ' HB2' HD11 ' A' ' 34' ' ' LEU . 50.9 m-70 -104.19 156.01 18.25 Favored 'General case' 0 C--N 1.328 -0.335 0 O-C-N 122.538 -0.39 . . . . 0.0 111.239 177.763 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.452 HD23 ' HG2' ' A' ' 28' ' ' ARG . 60.7 mt -117.35 141.13 48.69 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.318 174.476 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.527 HD11 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -157.48 146.57 19.84 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.303 175.225 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.474 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -60.15 159.69 9.31 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.814 0.34 . . . . 0.0 111.071 179.794 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.432 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 21.7 mmt180 -47.37 -55.54 8.67 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.072 -0.967 . . . . 0.0 112.684 -168.528 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.408 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 60.5 m -65.71 -48.08 73.2 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 120.742 0.306 . . . . 0.0 111.149 -177.739 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.474 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -56.39 -28.2 58.53 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.164 -178.202 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.527 ' HB2' HD11 ' A' ' 40' ' ' LEU . 60.5 t80 -59.32 -53.04 62.76 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.263 0.554 . . . . 0.0 109.935 174.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -65.1 -36.47 84.42 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.673 -176.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 43' ' ' THR . 42.0 mt-10 -61.82 -54.92 35.58 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.816 -179.144 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 25.6 ttp -64.32 -44.76 90.53 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.962 0.41 . . . . 0.0 110.284 -178.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 55.9 tp -63.69 -34.79 78.63 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.829 -178.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.8 ttpp -60.49 -46.53 89.78 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.098 0.475 . . . . 0.0 109.99 177.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -66.79 -35.1 79.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.079 177.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 62.2 33.78 87.02 Favored Glycine 0 C--N 1.333 0.402 0 CA-C-N 115.626 -0.716 . . . . 0.0 112.866 176.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -96.75 176.1 6.12 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.631 0.216 . . . . 0.0 110.452 179.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.8 mtm180 -58.28 123.11 14.95 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.904 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.4 p -53.91 108.28 1.08 Allowed Pre-proline 0 CA--C 1.533 0.299 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.804 -179.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.06 -16.85 57.23 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 122.89 2.393 . . . . 0.0 112.859 -174.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.556 HD23 ' HB3' ' A' ' 38' ' ' HIS . 4.8 mp -70.45 -16.82 62.97 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 121.054 0.454 . . . . 0.0 110.315 178.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -74.69 -20.2 59.95 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.226 173.321 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.573 ' SD ' ' N ' ' A' ' 59' ' ' MET . 1.1 mpt? -94.81 -47.81 6.3 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.26 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -142.15 115.05 8.68 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.765 -177.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 12.9 t . . . . . 0 C--O 1.25 1.116 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 176.614 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 . . . . . 0 N--CA 1.48 1.059 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 69.44 89.2 0.1 Allowed 'General case' 0 N--CA 1.466 0.336 0 O-C-N 123.857 0.723 . . . . 0.0 110.413 -178.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 30.4 m -127.1 129.42 71.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.326 179.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.4 m -73.27 145.99 45.71 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.155 177.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -53.65 -48.81 69.05 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 173.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 56.2 tp60 -142.44 141.98 32.28 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.563 -1.198 . . . . 0.0 108.268 168.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.402 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 9.3 p30 -96.87 136.7 37.05 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.801 0.334 . . . . 0.0 110.475 -178.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.484 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 18.2 t -87.08 110.03 29.82 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.077 171.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.402 ' HD3' ' O ' ' A' ' 16' ' ' ASN . 2.6 Cg_exo -74.85 -18.45 19.12 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.508 2.139 . . . . 0.0 110.896 176.346 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.484 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 15.9 mm -61.7 -25.56 37.29 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.377 -175.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.475 ' SG ' ' HG3' ' A' ' 22' ' ' GLU . 18.3 p -164.81 18.22 0.05 Allowed 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.266 -177.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 80.6 mt 49.91 83.68 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.21 0.529 . . . . 0.0 111.642 -175.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.475 ' HG3' ' SG ' ' A' ' 20' ' ' CYS . 35.3 mt-10 -144.95 155.7 43.56 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.811 176.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -71.91 141.31 49.51 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 123.693 0.621 . . . . 0.0 110.512 175.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 10.0 mt -136.32 136.47 48.98 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.604 176.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.495 ' HD2' ' HB2' ' A' ' 27' ' ' SER . 2.2 p-80 -113.88 145.33 41.62 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.138 177.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.8 m -59.28 -15.91 18.52 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -173.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.495 ' HB2' ' HD2' ' A' ' 25' ' ' HIS . 14.8 m -45.47 108.52 0.13 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.288 0.566 . . . . 0.0 111.049 177.778 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.404 ' NH2' HG23 ' A' ' 33' ' ' VAL . 9.4 tpt180 -69.63 -30.01 67.63 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.532 -165.365 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 45.8 t -76.28 -19.71 15.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.888 0.375 . . . . 0.0 111.211 -174.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 94.3 t -99.8 -46.62 12.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.09 -179.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.35 113.37 23.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.197 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -65.97 138.14 57.62 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.972 -178.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.404 HG23 ' NH2' ' A' ' 28' ' ' ARG . 7.3 p -93.8 131.53 40.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.271 0.558 . . . . 0.0 111.997 -176.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.627 HD11 ' HB2' ' A' ' 38' ' ' HIS . 60.4 mt -81.79 146.36 56.09 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.302 169.6 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -55.9 -20.85 30.98 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 122.591 2.194 . . . . 0.0 112.107 177.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.3 t -92.54 10.3 30.86 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.646 -177.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.59 17.91 59.4 Favored Glycine 0 C--N 1.337 0.61 0 N-CA-C 114.372 0.509 . . . . 0.0 114.372 170.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.627 ' HB2' HD11 ' A' ' 34' ' ' LEU . 47.3 m-70 -103.37 157.33 17.1 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 117.489 0.645 . . . . 0.0 110.671 177.673 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 91.6 mt -113.45 140.0 48.46 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.878 0.371 . . . . 0.0 110.881 177.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.489 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -152.33 159.18 43.5 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.733 176.476 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.46 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -71.95 168.83 17.17 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.65 0.262 . . . . 0.0 111.066 179.527 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 25.4 mmt180 -44.31 -62.26 1.23 Allowed 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.158 -0.928 . . . . 0.0 112.005 -174.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.6 m -64.77 -49.43 70.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.381 -175.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.46 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -56.47 -27.06 55.94 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.921 -0.581 . . . . 0.0 112.072 -176.003 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.489 ' HB2' HD13 ' A' ' 40' ' ' LEU . 42.4 t80 -58.18 -51.18 70.82 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.691 0.757 . . . . 0.0 109.64 173.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -71.81 -39.1 70.08 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.446 -1.252 . . . . 0.0 110.642 -176.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.47 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 42.5 mt-10 -57.7 -56.41 22.34 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.627 179.008 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 19.8 ttp -63.25 -45.11 93.07 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.127 -176.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 29.0 tp -66.45 -31.24 71.87 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.934 -176.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.3 ttpp -68.8 -48.27 64.04 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.121 178.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 6.2 mm-40 -64.76 -36.38 84.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.067 178.541 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.13 29.82 68.29 Favored Glycine 0 C--N 1.332 0.339 0 CA-C-N 115.604 -0.726 . . . . 0.0 113.626 173.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.411 ' CD1' ' HB2' ' A' ' 51' ' ' GLU . 39.0 p90 -89.18 169.81 11.14 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 117.045 0.423 . . . . 0.0 110.639 178.202 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 55.6 mtp180 -63.79 125.86 25.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.62 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -55.68 108.8 1.29 Allowed Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.838 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -65.61 -17.44 56.92 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 122.852 2.368 . . . . 0.0 112.389 -177.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.551 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -72.47 -8.43 55.03 Favored 'General case' 0 CA--C 1.528 0.112 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.545 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.98 -24.04 61.52 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.837 0.351 . . . . 0.0 110.563 177.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 14.7 tmm? -71.15 -28.08 64.01 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.222 176.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -65.75 156.2 33.82 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.815 -178.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.4 t . . . . . 0 C--O 1.252 1.21 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 177.618 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 . . . . . 0 N--CA 1.48 1.034 0 CA-C-O 120.786 0.327 . . . . 0.0 110.345 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -110.1 30.67 6.52 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.428 0.632 . . . . 0.0 110.004 175.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 47.9 t -71.92 82.95 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.202 -178.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 17.0 m -84.18 -17.3 40.39 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.56 0.695 . . . . 0.0 109.473 177.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 21.6 mp0 -78.97 99.56 6.89 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.085 -178.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.414 ' O ' ' HB ' ' A' ' 24' ' ' ILE . 29.9 tt0 -60.56 113.07 2.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.55 176.25 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.403 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 33.4 p30 -76.87 152.08 35.57 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.522 0.677 . . . . 0.0 111.565 -173.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 10.5 t -87.79 108.46 20.86 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.481 172.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.403 ' HD3' ' O ' ' A' ' 16' ' ' ASN . 22.4 Cg_exo -63.54 -28.89 70.39 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.407 2.071 . . . . 0.0 111.26 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 8.5 mm -57.14 -23.09 17.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.759 -173.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.4 p -158.08 14.76 0.21 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 120.702 0.287 . . . . 0.0 110.937 178.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 90.3 mt 45.9 67.55 0.73 Allowed 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.543 0.687 . . . . 0.0 111.618 -176.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -136.06 -177.92 4.91 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 114.986 -1.006 . . . . 0.0 109.971 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -77.54 151.93 34.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.882 0.372 . . . . 0.0 111.641 -177.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.452 HD11 ' HA ' ' A' ' 40' ' ' LEU . 2.9 mt -147.72 146.08 18.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.274 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.333 172.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.439 ' CG ' ' H ' ' A' ' 26' ' ' THR . 3.5 t-160 -127.69 -178.66 4.57 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.448 0.166 . . . . 0.0 110.762 -177.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.439 ' H ' ' CG ' ' A' ' 25' ' ' HIS . 6.3 m -72.61 -33.2 66.53 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -167.195 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.5 t -59.08 117.59 4.88 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 120.894 0.378 . . . . 0.0 112.002 -171.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.511 ' HG3' HD22 ' A' ' 39' ' ' LEU . 6.8 mpt_? -76.8 -6.9 54.18 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.897 176.511 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.5 t -87.17 -35.02 7.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.698 178.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.1 t -81.4 -55.26 8.39 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.883 176.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -94.66 125.38 39.27 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.697 177.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -67.89 133.03 48.44 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 -178.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.7 p -87.57 116.62 30.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-O 121.106 0.479 . . . . 0.0 111.008 179.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.554 HD13 ' HB2' ' A' ' 38' ' ' HIS . 73.3 mt -65.7 155.42 86.14 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.462 175.396 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.26 -14.76 25.73 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.791 2.327 . . . . 0.0 112.423 178.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 48.9 t -101.57 11.02 39.7 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.78 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 83.45 22.22 56.87 Favored Glycine 0 C--N 1.335 0.511 0 CA-C-N 116.224 -0.444 . . . . 0.0 114.153 171.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.572 ' HB3' HD22 ' A' ' 57' ' ' LEU . 48.7 m-70 -103.01 156.66 17.52 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 117.281 0.54 . . . . 0.0 110.909 177.406 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.511 HD22 ' HG3' ' A' ' 28' ' ' ARG . 80.4 mt -113.11 141.25 47.13 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.865 0.364 . . . . 0.0 110.79 177.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.532 HD12 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -157.85 150.15 22.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.949 175.263 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.492 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -64.64 165.33 10.42 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.703 0.287 . . . . 0.0 111.433 179.339 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.446 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 10.0 mmm180 -48.88 -66.26 0.43 Allowed 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.121 -0.945 . . . . 0.0 112.876 -171.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 48.1 m -58.06 -40.89 82.14 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.962 0.41 . . . . 0.0 110.842 -175.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.492 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.5 OUTLIER -65.94 -29.57 70.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.81 179.755 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.532 ' HB2' HD12 ' A' ' 40' ' ' LEU . 20.8 t80 -63.46 -55.6 22.88 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.394 178.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -59.24 -49.4 77.98 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.967 -175.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.427 ' HA ' ' HD3' ' A' ' 50' ' ' LYS . 7.3 mm-40 -57.19 -43.34 82.61 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.988 -178.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.436 ' SD ' ' C ' ' A' ' 48' ' ' MET . 0.7 OUTLIER -68.72 -44.48 73.79 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 121.069 0.462 . . . . 0.0 110.358 178.898 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.459 ' O ' HD12 ' A' ' 49' ' ' LEU . 2.3 tm? -66.2 -33.66 76.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.625 -174.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.427 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 46.6 mtpt -59.15 -34.36 71.99 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.968 178.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -96.15 -38.72 10.04 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.983 -177.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 65.12 26.95 71.77 Favored Glycine 0 CA--C 1.518 0.261 0 CA-C-N 115.99 -0.55 . . . . 0.0 112.375 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 33.7 p90 -70.71 177.92 3.32 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 122.425 0.29 . . . . 0.0 111.166 -177.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.419 ' O ' ' HD3' ' A' ' 56' ' ' PRO . 15.2 mmt180 -56.65 121.57 10.05 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.837 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.2 p -73.46 105.83 1.93 Allowed Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.413 -178.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.419 ' HD3' ' O ' ' A' ' 54' ' ' ARG . 46.4 Cg_endo -66.8 -13.79 41.28 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 122.58 2.187 . . . . 0.0 112.156 -176.655 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.572 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -73.54 -14.94 61.3 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.296 179.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.53 -24.48 67.62 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.459 177.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -71.95 -25.64 61.95 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.783 179.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 17.7 t60 -111.3 142.83 43.01 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.593 -177.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 7.9 p . . . . . 0 C--O 1.253 1.251 0 CA-C-O 118.457 -0.782 . . . . 0.0 110.228 175.419 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 . . . . . 0 N--CA 1.482 1.137 0 N-CA-C 111.357 0.132 . . . . 0.0 111.357 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.9 p-10 -69.1 139.46 54.77 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.974 0.416 . . . . 0.0 111.043 -176.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 35.2 m -125.75 148.13 30.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.19 177.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.5 t -104.91 21.47 16.95 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.21 0.529 . . . . 0.0 109.969 -179.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -118.46 173.74 6.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.349 -178.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.493 ' HB2' ' O ' ' A' ' 24' ' ' ILE . 1.7 mp0 -88.2 172.48 9.44 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 172.752 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 39.9 p30 -150.81 161.48 42.59 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.163 0.506 . . . . 0.0 111.108 -179.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.449 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 44.8 t -108.79 108.16 60.57 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.593 172.377 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -74.01 -14.97 23.59 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.264 1.976 . . . . 0.0 111.469 177.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.449 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 23.3 mm -64.44 -24.13 34.96 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.046 -177.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.0 p -161.16 10.81 0.09 Allowed 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 -177.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 9.3 mp 54.76 94.12 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.314 0.578 . . . . 0.0 110.569 -172.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -160.02 164.35 33.28 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.859 -178.069 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -73.83 137.55 43.87 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.734 -179.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.493 ' O ' ' HB2' ' A' ' 15' ' ' GLN . 5.2 mt -141.12 148.33 21.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 174.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -134.98 166.0 24.04 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.0 m -52.06 -17.03 0.89 Allowed 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 122.994 0.518 . . . . 0.0 112.05 177.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.3 m -48.73 86.79 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.328 0.651 . . . . 0.0 111.882 179.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 50.2 ttp180 -81.1 -4.95 56.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.894 -176.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 47.9 t -80.27 -36.84 16.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.267 0.556 . . . . 0.0 109.741 175.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.2 t -88.65 -54.41 7.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.531 177.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.94 117.83 18.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.123 -179.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 48.4 t60 -69.52 127.56 33.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.036 -179.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.9 p -88.45 118.6 34.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.245 0.545 . . . . 0.0 111.284 -177.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.563 HD11 ' HB2' ' A' ' 38' ' ' HIS . 92.7 mt -62.81 150.4 87.4 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.755 172.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -59.05 -12.76 16.52 Favored 'Trans proline' 0 CA--C 1.535 0.537 0 C-N-CA 122.712 2.275 . . . . 0.0 112.953 177.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.3 t -96.91 6.69 48.18 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.77 0.319 . . . . 0.0 110.801 178.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.14 19.99 47.94 Favored Glycine 0 C--N 1.337 0.632 0 N-CA-C 114.286 0.474 . . . . 0.0 114.286 172.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.563 ' HB2' HD11 ' A' ' 34' ' ' LEU . 39.9 m-70 -104.0 156.87 17.51 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 117.505 0.652 . . . . 0.0 110.981 178.01 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.6 mt -113.65 137.07 52.12 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.79 0.328 . . . . 0.0 111.189 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.548 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -157.24 157.5 34.41 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.859 174.661 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.498 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -72.31 166.65 22.04 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.174 -179.693 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.486 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 26.3 mmm180 -49.13 -64.02 0.93 Allowed 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -172.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.486 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 27.2 m -60.56 -41.56 94.82 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.572 0.225 . . . . 0.0 110.628 -175.432 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.498 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -62.34 -27.57 69.15 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 120.884 0.373 . . . . 0.0 110.479 178.535 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.548 ' HB2' HD13 ' A' ' 40' ' ' LEU . 25.0 t80 -70.74 -44.76 66.13 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.933 174.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -66.9 -27.9 67.87 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.677 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.486 ' HG3' ' O ' ' A' ' 43' ' ' THR . 43.9 mt-10 -73.21 -51.79 16.46 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.24 175.136 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.446 ' SD ' ' C ' ' A' ' 48' ' ' MET . 0.6 OUTLIER -62.32 -54.27 42.94 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.894 -176.776 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 65.6 tp -61.72 -28.44 69.42 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.095 -177.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.699 ' HZ2' ' HB2' ' A' ' 50' ' ' LYS . 4.6 ttmp? -61.49 -40.63 95.29 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.057 0.456 . . . . 0.0 110.579 178.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -88.25 -33.12 18.19 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.011 -178.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 61.64 29.95 73.41 Favored Glycine 0 C--N 1.334 0.466 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.307 -178.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.479 ' HB2' ' NH1' ' A' ' 54' ' ' ARG . 16.0 p90 -82.52 174.04 11.43 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 120.806 0.336 . . . . 0.0 111.154 -175.351 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.479 ' NH1' ' HB2' ' A' ' 53' ' ' TYR . 0.3 OUTLIER -57.44 138.79 54.62 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.747 177.939 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -90.37 107.17 18.08 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -175.353 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -63.63 -15.0 46.07 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.781 2.321 . . . . 0.0 112.192 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.536 HD23 ' HB3' ' A' ' 38' ' ' HIS . 4.9 mp -75.38 -6.64 51.01 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.418 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -73.11 -34.86 66.4 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.014 0.435 . . . . 0.0 109.869 173.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 23.5 ttt -73.29 -49.33 28.18 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.299 176.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 80.2 t60 -72.45 139.13 47.55 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.918 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.5 m . . . . . 0 C--O 1.251 1.163 0 CA-C-O 118.614 -0.707 . . . . 0.0 110.148 178.884 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 . . . . . 0 N--CA 1.484 1.249 0 CA-C-O 121.114 0.483 . . . . 0.0 110.586 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.465 ' HA ' HE22 ' A' ' 14' ' ' GLN . 2.4 m-20 -77.2 77.69 3.73 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.764 -178.116 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 54.8 t -73.75 -77.13 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 176.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.7 m -157.55 98.22 1.66 Allowed 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.367 177.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.465 HE22 ' HA ' ' A' ' 11' ' ' ASN . 21.8 mp0 -76.24 136.65 39.68 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.706 175.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.548 ' O ' ' HB ' ' A' ' 24' ' ' ILE . 15.0 mm100 -62.41 111.06 1.86 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.907 0.384 . . . . 0.0 110.72 178.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -80.92 151.03 28.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.778 178.147 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.493 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 22.1 t -82.92 108.78 13.54 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.365 177.324 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -74.89 -7.42 19.23 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.269 1.979 . . . . 0.0 111.437 179.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.493 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 21.3 mm -72.3 -22.98 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.41 178.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.691 ' SG ' ' HG3' ' A' ' 22' ' ' GLU . 21.3 p -163.09 22.62 0.09 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 120.726 0.298 . . . . 0.0 111.574 -179.528 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 7.1 mp 57.32 25.93 11.79 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 174.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.691 ' HG3' ' SG ' ' A' ' 20' ' ' CYS . 54.0 mt-10 -93.28 -179.42 5.06 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 120.712 0.291 . . . . 0.0 110.62 178.257 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -90.39 149.53 22.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.406 177.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.548 ' HB ' ' O ' ' A' ' 15' ' ' GLN . 6.4 mt -137.08 137.19 46.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 175.497 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 18.3 t60 -111.82 156.47 21.93 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 -177.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.5 t -56.7 -16.96 7.3 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -177.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.0 t -61.65 93.88 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.137 0.494 . . . . 0.0 110.839 -178.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 50.0 ttp180 -76.61 -14.32 60.0 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.625 -178.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.8 p -68.57 -19.03 23.87 Favored 'Isoleucine or valine' 0 C--O 1.238 0.447 0 CA-C-O 121.473 0.654 . . . . 0.0 109.495 173.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 61.2 t -99.09 -63.14 1.72 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.533 173.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.77 123.05 21.77 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.21 -178.017 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -76.17 140.31 41.67 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.804 178.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.402 ' HA ' ' O ' ' A' ' 38' ' ' HIS . 7.5 p -98.05 120.13 46.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-O 121.183 0.516 . . . . 0.0 111.308 -179.421 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.594 HD13 ' HB2' ' A' ' 38' ' ' HIS . 84.6 mt -61.27 148.65 84.88 Favored Pre-proline 0 C--O 1.233 0.215 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.022 172.742 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -56.8 -19.68 32.27 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.595 2.197 . . . . 0.0 112.45 179.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 46.7 t -88.98 0.35 56.73 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.975 -178.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.35 19.33 28.24 Favored Glycine 0 C--N 1.335 0.502 0 C-N-CA 121.41 -0.424 . . . . 0.0 114.084 174.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.594 ' HB2' HD13 ' A' ' 34' ' ' LEU . 54.6 m-70 -103.32 156.62 17.6 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 117.424 0.612 . . . . 0.0 111.241 179.412 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.0 mt -112.98 139.8 48.33 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 120.848 0.356 . . . . 0.0 111.445 178.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.543 HD12 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -162.86 149.04 12.37 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.579 176.178 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.567 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -58.9 158.43 8.33 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.042 175.547 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.519 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 9.9 mmt85 -50.91 -58.24 6.5 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 115.729 -0.668 . . . . 0.0 112.241 -170.316 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.435 ' O ' ' HG2' ' A' ' 47' ' ' GLU . 26.6 m -55.84 -44.25 77.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.238 -177.716 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.567 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -62.44 -31.9 72.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.764 179.267 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.543 ' HB2' HD12 ' A' ' 40' ' ' LEU . 34.5 t80 -62.34 -47.67 83.19 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.845 175.554 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -62.35 -51.47 67.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.56 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 43' ' ' THR . 23.0 mm-40 -62.84 -37.18 85.78 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.583 -177.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.453 ' SD ' ' C ' ' A' ' 48' ' ' MET . 0.5 OUTLIER -67.89 -51.36 48.93 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.255 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.4 tp -66.64 -28.42 68.46 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.589 -179.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -57.5 -50.62 72.47 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.371 177.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.5 mm-40 -79.92 -32.73 40.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.46 178.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 61.8 32.86 83.29 Favored Glycine 0 C--N 1.331 0.276 0 CA-C-N 115.91 -0.587 . . . . 0.0 112.46 179.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 22.8 p90 -77.66 -175.93 4.1 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.858 0.361 . . . . 0.0 110.727 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.489 ' HD2' ' N ' ' A' ' 54' ' ' ARG . 2.4 mpt_? -72.73 122.37 21.39 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -177.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.4 p -61.8 107.3 1.07 Allowed Pre-proline 0 C--N 1.329 -0.323 0 O-C-N 123.102 0.251 . . . . 0.0 111.273 -178.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -59.84 -28.9 88.26 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.748 2.299 . . . . 0.0 112.163 -173.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.554 HD21 ' HB3' ' A' ' 38' ' ' HIS . 4.6 mp -62.61 -16.81 58.42 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.952 0.406 . . . . 0.0 110.85 -177.161 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -74.73 -32.99 62.29 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.617 176.608 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 28.1 ttt -109.9 -23.12 11.53 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -174.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.432 ' O ' ' HA ' ' A' ' 57' ' ' LEU . 59.4 t-80 -151.38 151.51 31.83 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -174.311 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 31.6 t . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.178 -0.915 . . . . 0.0 109.29 176.571 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 . . . . . 0 N--CA 1.481 1.105 0 CA-C-O 120.498 0.19 . . . . 0.0 111.13 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -160.07 121.26 3.11 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 179.019 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 10.9 p -96.39 -19.31 6.21 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.198 -179.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 41.4 p -64.6 108.92 1.82 Allowed 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.055 0.455 . . . . 0.0 111.445 -176.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -155.45 155.02 32.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.374 175.359 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.461 ' HB2' HG21 ' A' ' 24' ' ' ILE . 83.8 mm-40 -121.85 154.06 37.55 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 -178.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 -112.3 144.29 41.96 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.836 0.35 . . . . 0.0 110.354 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.442 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 43.5 t -92.27 108.19 28.95 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.704 176.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -76.52 -8.67 18.43 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.246 1.964 . . . . 0.0 111.617 177.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.442 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 20.6 mm -70.91 -23.12 23.43 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.943 -177.58 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.468 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 21.4 p -162.18 12.63 0.08 Allowed 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -177.391 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 7.5 mp 54.97 91.02 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.215 0.531 . . . . 0.0 109.92 -171.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.468 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 0.4 OUTLIER -155.37 167.48 30.24 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.361 -174.134 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -88.92 143.32 26.95 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.708 0.29 . . . . 0.0 110.401 179.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.461 HG21 ' HB2' ' A' ' 15' ' ' GLN . 11.4 mt -142.48 142.24 27.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -123.74 177.6 5.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.276 179.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 15.2 t -75.81 -15.82 60.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.593 -173.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.5 m -57.52 89.91 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 120.927 0.394 . . . . 0.0 111.224 179.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.443 ' HG2' HD23 ' A' ' 39' ' ' LEU . 82.8 mtt85 -71.81 -11.48 60.83 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.055 -177.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 66.6 t -66.74 -35.31 74.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.232 0.539 . . . . 0.0 109.994 173.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 40.0 t -94.08 -53.69 8.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.951 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -84.54 116.8 23.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.061 178.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -65.38 124.82 23.26 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.273 -177.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.479 ' HA ' HD21 ' A' ' 39' ' ' LEU . 7.3 p -80.73 116.94 25.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.099 0.476 . . . . 0.0 110.95 178.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.598 HD12 ' HB2' ' A' ' 38' ' ' HIS . 76.2 mt -65.98 154.91 88.42 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.046 174.149 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -67.99 -5.55 14.91 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.323 2.015 . . . . 0.0 111.475 178.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 30.2 t -106.03 14.49 27.76 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.402 178.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.66 2.53 75.69 Favored Glycine 0 C--N 1.341 0.846 0 N-CA-C 114.948 0.739 . . . . 0.0 114.948 169.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.598 ' HB2' HD12 ' A' ' 34' ' ' LEU . 25.9 m-70 -96.95 156.83 16.18 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 117.525 0.662 . . . . 0.0 111.339 -175.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.479 HD21 ' HA ' ' A' ' 33' ' ' VAL . 98.1 mt -114.0 142.57 46.0 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.876 178.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.509 HD12 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -157.04 152.12 26.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.862 175.872 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.519 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -66.15 167.82 9.48 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.991 178.761 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.493 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 15.4 mmm180 -50.17 -60.45 2.95 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.174 -169.233 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 28.3 m -66.22 -41.43 90.09 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.247 -175.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.519 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -60.8 -26.38 67.25 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 120.77 0.319 . . . . 0.0 110.694 -178.941 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.509 ' HB2' HD12 ' A' ' 40' ' ' LEU . 39.5 t80 -59.67 -48.84 80.1 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.008 174.566 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -65.82 -44.31 85.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.629 -179.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -57.8 -51.69 68.52 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.925 -178.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 9.5 tmm? -65.0 -49.39 70.43 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.19 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 54.1 tp -62.12 -31.1 71.53 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.103 -177.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.4 ttmm -63.58 -40.44 96.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.918 0.389 . . . . 0.0 110.272 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -75.62 -41.4 54.41 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.363 176.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.87 45.92 94.32 Favored Glycine 0 C--N 1.333 0.388 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 -176.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -102.91 -175.71 2.89 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.784 0.325 . . . . 0.0 110.513 -175.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.444 ' HG3' ' O ' ' A' ' 54' ' ' ARG . 34.8 ptt180 -56.78 110.6 0.83 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.296 177.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.427 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 0.8 OUTLIER -64.81 105.48 0.74 Allowed Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.731 -0.213 . . . . 0.0 110.646 178.936 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -59.49 -22.51 66.66 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 122.806 2.337 . . . . 0.0 112.408 -172.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.543 HD21 ' HB3' ' A' ' 38' ' ' HIS . 4.3 mp -66.93 -20.55 65.92 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.518 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.7 OUTLIER -64.2 -42.6 96.56 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.096 174.606 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 66.8 mtt -92.32 -3.94 54.65 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.207 177.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 62.5 m80 65.86 14.41 9.55 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.876 -178.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.3 p . . . . . 0 C--O 1.251 1.147 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.612 -177.209 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 . . . . . 0 N--CA 1.48 1.055 0 CA-C-O 120.759 0.314 . . . . 0.0 110.316 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -113.51 110.33 20.1 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.895 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 34.3 m -108.5 0.67 9.7 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.024 -177.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 42.0 t -75.07 -25.94 58.98 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.098 -177.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -109.01 172.36 6.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.883 -175.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.507 ' O ' ' HB ' ' A' ' 24' ' ' ILE . 24.5 mm-40 -87.06 98.8 11.48 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 175.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.449 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 12.9 m120 -80.05 141.98 35.35 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.078 -174.223 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.442 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 44.1 t -80.4 109.41 12.66 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.497 175.251 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.503 ' HG2' ' HG2' ' A' ' 56' ' ' PRO . 92.5 Cg_endo -80.86 -4.92 12.96 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.454 2.103 . . . . 0.0 111.665 177.22 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.442 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 19.0 mm -72.96 -20.29 18.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.705 -178.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.708 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 21.2 p -163.61 17.69 0.07 Allowed 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.243 -179.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.442 ' N ' HD11 ' A' ' 21' ' ' LEU . 6.4 mp 49.08 80.0 0.07 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.164 0.506 . . . . 0.0 109.969 -174.052 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.708 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 0.5 OUTLIER -150.24 170.67 18.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.66 -173.078 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -82.93 137.49 34.19 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 122.889 0.475 . . . . 0.0 111.406 -177.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.507 ' HB ' ' O ' ' A' ' 15' ' ' GLN . 26.6 mt -136.72 131.32 47.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 109.641 -0.504 . . . . 0.0 109.641 171.469 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 66.7 m170 -117.37 178.73 4.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.588 178.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.9 t -65.46 -17.31 64.45 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -174.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 67.7 m -60.12 94.52 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.055 0.455 . . . . 0.0 111.562 -178.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.6 mtt85 -80.45 17.29 1.11 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.667 -178.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.6 t -88.94 -51.8 11.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.122 0.487 . . . . 0.0 109.705 173.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 57.6 t -84.32 -38.18 13.49 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.977 177.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.412 ' HB2' ' HB3' ' A' ' 39' ' ' LEU . . . -82.19 97.65 8.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.801 175.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.4 ' O ' HD11 ' A' ' 40' ' ' LEU . 9.3 t60 -61.11 136.48 58.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.912 -178.547 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.7 p -89.76 124.69 42.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.213 0.53 . . . . 0.0 111.222 -177.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.61 HD11 ' HB2' ' A' ' 38' ' ' HIS . 60.5 mt -76.27 151.85 83.65 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.408 174.515 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.5 -22.5 35.01 Favored 'Trans proline' 0 CA--C 1.535 0.531 0 C-N-CA 122.58 2.186 . . . . 0.0 112.295 175.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.2 t -95.46 12.8 28.1 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.853 -177.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 83.8 15.6 70.01 Favored Glycine 0 C--N 1.337 0.627 0 N-CA-C 114.5 0.56 . . . . 0.0 114.5 170.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.61 ' HB2' HD11 ' A' ' 34' ' ' LEU . 59.3 m-70 -100.01 156.62 17.06 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 117.555 0.678 . . . . 0.0 110.619 178.044 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.412 ' HB3' ' HB2' ' A' ' 31' ' ' ALA . 97.1 mt -112.66 142.5 45.19 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.674 176.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.522 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -159.27 140.79 13.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.784 175.006 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.511 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -54.18 155.42 3.68 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.648 0.261 . . . . 0.0 111.413 179.115 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.498 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 55.1 mmm-85 -36.35 -66.57 0.21 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.26 1.024 . . . . 0.0 113.284 -173.265 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 30.8 m -64.53 -36.58 84.65 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.762 0.315 . . . . 0.0 111.486 -172.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.511 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -64.14 -28.54 69.83 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.736 -178.942 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.522 ' HB2' HD13 ' A' ' 40' ' ' LEU . 32.3 t80 -58.49 -50.03 75.22 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.818 175.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -66.63 -41.61 88.04 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.232 -178.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.409 ' O ' ' HB3' ' A' ' 50' ' ' LYS . 19.2 mm-40 -56.58 -54.99 39.58 Favored 'General case' 0 C--O 1.235 0.335 0 O-C-N 123.332 0.395 . . . . 0.0 111.724 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 14.7 ttp -61.67 -49.67 75.57 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.141 0.496 . . . . 0.0 110.338 -178.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 32.0 tp -64.7 -28.61 69.72 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.539 -178.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.409 ' HB3' ' O ' ' A' ' 47' ' ' GLU . 34.7 ttpt -63.61 -47.85 79.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.405 177.357 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -75.4 -26.95 58.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.75 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 62.9 25.97 68.38 Favored Glycine 0 C--N 1.331 0.304 0 CA-C-N 115.956 -0.565 . . . . 0.0 113.27 175.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 20.0 p90 -83.71 176.12 9.19 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 178.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 32.3 mtp180 -70.3 130.6 42.42 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 -176.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.405 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 1.5 p -60.37 107.4 1.03 Allowed Pre-proline 0 CA--C 1.532 0.258 0 CA-C-O 120.663 0.268 . . . . 0.0 111.553 -178.542 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.503 ' HG2' ' HG2' ' A' ' 18' ' ' PRO . 39.5 Cg_endo -66.19 -18.21 55.7 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.757 2.304 . . . . 0.0 112.32 -175.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.572 HD21 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -69.88 -13.25 62.16 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 120.937 0.399 . . . . 0.0 110.182 179.247 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.8 OUTLIER -74.04 -22.8 59.41 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.319 173.262 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 27.3 ttt -83.5 -49.46 9.24 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 178.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 13.5 p-80 -171.22 162.27 6.86 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.466 171.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 52.0 p . . . . . 0 C--O 1.25 1.12 0 CA-C-O 118.393 -0.813 . . . . 0.0 109.828 179.432 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.864 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -78.26 92.59 4.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.477 0.656 . . . . 0.0 110.587 -179.182 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 17.2 m -98.15 108.82 22.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.822 175.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 62.7 m -70.38 80.63 0.55 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.408 0.623 . . . . 0.0 111.357 -176.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 80.0 mm-40 -111.22 153.51 25.74 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.012 173.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.419 ' HB2' ' O ' ' A' ' 24' ' ' ILE . 15.7 mm-40 -69.04 87.69 0.39 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.361 0.601 . . . . 0.0 110.183 -177.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 -90.12 141.41 28.71 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.624 -179.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.409 ' HB2' HG13 ' A' ' 24' ' ' ILE . 33.4 t -72.6 110.07 7.41 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.759 177.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.559 ' HG2' ' HG ' ' A' ' 57' ' ' LEU . 15.6 Cg_exo -67.62 -19.94 47.51 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.464 2.109 . . . . 0.0 111.373 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.458 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 10.4 mm -70.04 -18.39 21.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.387 -174.514 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.582 ' SG ' ' HG3' ' A' ' 22' ' ' GLU . 19.1 p -167.87 21.95 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 121.047 -0.261 . . . . 0.0 111.689 -178.331 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 89.3 mt 55.98 28.69 13.07 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.582 ' HG3' ' SG ' ' A' ' 20' ' ' CYS . 39.0 mt-10 -91.54 -177.73 4.89 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 177.072 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -91.94 151.56 20.46 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.889 0.376 . . . . 0.0 110.475 175.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.419 ' O ' ' HB2' ' A' ' 15' ' ' GLN . 15.2 mt -143.05 111.98 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 173.06 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 35.4 t60 -89.88 150.91 22.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.178 -177.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 12.9 m -53.36 -25.46 15.38 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.085 -177.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.8 p -64.74 89.47 0.07 Allowed 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.09 0.471 . . . . 0.0 110.367 177.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.2 ppt_? -78.22 18.96 0.47 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.997 -175.408 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.8 p -73.05 -30.95 33.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-O 121.206 0.527 . . . . 0.0 109.687 172.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.0 p -101.62 -38.55 6.01 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.436 177.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -82.6 111.11 18.28 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.51 179.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -64.82 133.52 52.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.117 -179.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.3 p -92.1 122.14 43.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.082 0.468 . . . . 0.0 111.131 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.572 HD13 ' HB2' ' A' ' 38' ' ' HIS . 82.7 mt -67.81 155.08 92.42 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.639 172.119 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.41 -12.82 35.02 Favored 'Trans proline' 0 CA--C 1.531 0.357 0 C-N-CA 122.102 1.868 . . . . 0.0 111.736 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 38.4 t -100.74 13.69 34.07 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.593 -179.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.19 17.34 65.03 Favored Glycine 0 C--N 1.336 0.578 0 N-CA-C 114.458 0.543 . . . . 0.0 114.458 169.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.581 ' HB3' HD21 ' A' ' 57' ' ' LEU . 41.9 m-70 -103.27 156.11 17.96 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 117.53 0.665 . . . . 0.0 110.421 177.426 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.5 mt -112.01 144.6 41.09 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.849 0.357 . . . . 0.0 111.252 -179.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.539 HD12 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -163.31 151.47 13.62 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.301 175.551 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.557 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -69.83 163.28 26.2 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.886 178.165 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.469 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 57.3 mmm-85 -48.53 -57.67 5.81 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 123.822 0.701 . . . . 0.0 112.183 -174.576 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 42.8 p -52.73 -57.04 11.4 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.423 0.63 . . . . 0.0 110.599 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.557 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.5 OUTLIER -58.15 -26.67 62.99 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.111 -0.95 . . . . 0.0 111.679 -179.971 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.539 ' HB2' HD12 ' A' ' 40' ' ' LEU . 39.6 t80 -66.71 -48.98 67.51 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 177.427 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -63.98 -43.57 95.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.455 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -57.2 -53.05 62.46 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.138 178.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.431 ' SD ' ' C ' ' A' ' 48' ' ' MET . 1.0 OUTLIER -65.61 -50.87 63.47 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.618 -177.063 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 42.8 tp -62.85 -30.28 71.38 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.715 -177.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 45.8 tttm -62.1 -51.48 67.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.127 0.489 . . . . 0.0 110.214 175.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.406 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 11.0 mm-40 -67.25 -35.44 79.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.641 -177.102 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 63.34 24.48 67.51 Favored Glycine 0 CA--C 1.519 0.32 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.937 176.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.406 ' HD1' ' HB2' ' A' ' 51' ' ' GLU . 14.8 p90 -79.77 163.4 24.49 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.512 ' H ' ' HD3' ' A' ' 54' ' ' ARG . 0.8 OUTLIER -61.07 130.33 45.8 Favored 'General case' 0 C--N 1.332 -0.152 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 -179.496 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.2 p -64.65 114.06 13.11 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.148 -174.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -67.96 -24.8 39.1 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.735 2.29 . . . . 0.0 111.879 -178.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.581 HD21 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -65.25 -15.79 62.86 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.62 -178.313 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.83 -21.59 66.82 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.871 0.367 . . . . 0.0 110.676 175.022 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.1 mpp? -110.44 14.23 22.61 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.425 175.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.402 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 57.1 t-80 -139.77 93.05 2.61 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 -178.378 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 34.9 m . . . . . 0 C--O 1.251 1.143 0 CA-C-O 118.856 -0.592 . . . . 0.0 109.778 -178.639 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 . . . . . 0 N--CA 1.479 1.009 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 50.9 m-80 -59.64 88.46 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.007 0.432 . . . . 0.0 111.296 -178.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 45.4 t -129.5 101.39 6.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 174.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.0 m -64.92 100.22 0.4 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.297 -176.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -157.8 133.85 9.38 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.76 179.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.408 ' OE1' ' HA ' ' A' ' 15' ' ' GLN . 14.4 mm-40 -92.65 97.63 10.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.189 0.519 . . . . 0.0 110.214 -179.486 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 -96.62 138.25 34.47 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.396 179.265 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.518 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 18.8 t -78.31 111.05 15.94 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.267 179.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -72.87 -12.98 26.55 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.214 1.943 . . . . 0.0 111.677 177.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.518 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 24.4 mm -71.35 -19.23 20.66 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.155 -178.07 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.6 p -168.31 20.5 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 120.962 -0.295 . . . . 0.0 111.775 -179.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.437 HD11 ' N ' ' A' ' 21' ' ' LEU . 6.3 mp 48.26 72.72 0.25 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.009 0.433 . . . . 0.0 110.716 -177.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -146.64 -176.62 5.26 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.379 -173.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -78.12 139.29 39.02 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.086 -176.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.453 HD11 ' O ' ' A' ' 39' ' ' LEU . 11.9 mt -145.43 140.31 22.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.288 169.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 22.8 m80 -145.46 173.47 11.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.635 0.255 . . . . 0.0 110.605 176.09 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 63.2 m -60.0 -24.64 64.62 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.802 -0.636 . . . . 0.0 112.691 -173.305 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -55.4 98.69 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.186 0.517 . . . . 0.0 110.853 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.49 -25.19 66.58 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.714 -174.693 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.451 HG12 HG22 ' A' ' 30' ' ' VAL . 13.6 p -58.27 -31.27 42.01 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-O 121.084 0.469 . . . . 0.0 110.162 179.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.451 HG22 HG12 ' A' ' 29' ' ' VAL . 73.0 t -96.61 -49.47 12.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.008 177.218 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.524 ' HB3' ' HB3' ' A' ' 39' ' ' LEU . . . -94.59 103.79 15.74 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.088 -177.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -66.56 139.37 57.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.855 178.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 52.4 t -87.19 120.85 37.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-O 120.735 0.302 . . . . 0.0 111.279 -178.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.563 HD12 ' HB2' ' A' ' 38' ' ' HIS . 55.2 mt -73.45 152.82 89.92 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.331 172.749 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -64.11 1.15 1.69 Allowed 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 123.241 2.627 . . . . 0.0 113.583 -178.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 47.7 t -115.7 4.26 14.03 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.781 0.325 . . . . 0.0 110.818 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.48 24.23 26.72 Favored Glycine 0 C--N 1.335 0.505 0 C-N-CA 121.219 -0.515 . . . . 0.0 113.987 173.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.563 ' HB2' HD12 ' A' ' 34' ' ' LEU . 69.1 m-70 -103.48 155.52 18.45 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 117.115 0.457 . . . . 0.0 110.669 174.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.524 ' HB3' ' HB3' ' A' ' 31' ' ' ALA . 88.8 mt -113.01 142.68 45.43 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.451 177.333 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.537 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -158.04 140.4 14.39 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.759 174.362 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.561 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -55.55 156.2 4.87 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.865 0.364 . . . . 0.0 111.096 -179.653 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.549 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 8.6 mmm180 -43.75 -59.81 2.07 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 114.857 -1.065 . . . . 0.0 113.098 -168.588 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 18.5 m -67.24 -37.65 83.9 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.605 0.241 . . . . 0.0 111.442 -174.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.561 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -62.19 -27.41 68.95 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.904 0.383 . . . . 0.0 110.289 179.243 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.549 ' HB3' ' O ' ' A' ' 42' ' ' ARG . 41.8 t80 -60.85 -47.45 86.32 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.103 175.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -60.85 -45.87 92.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.409 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.442 ' HA ' ' HE2' ' A' ' 50' ' ' LYS . 11.7 mm-40 -63.6 -40.02 95.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.849 -177.142 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.429 ' C ' ' SD ' ' A' ' 48' ' ' MET . 8.5 tmm? -72.64 -51.2 20.55 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.147 0.498 . . . . 0.0 109.708 179.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.8 tp -60.29 -27.69 67.49 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.617 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.442 ' HE2' ' HA ' ' A' ' 47' ' ' GLU . 17.3 ttmm -49.64 -38.73 33.49 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.226 177.018 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.8 mm-40 -93.73 -38.76 11.13 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.942 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 63.02 20.73 62.86 Favored Glycine 0 C--N 1.333 0.391 0 C-N-CA 121.14 -0.552 . . . . 0.0 112.418 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -71.14 -173.7 0.88 Allowed 'General case' 0 C--O 1.237 0.419 0 CA-C-O 120.88 0.371 . . . . 0.0 111.576 -178.567 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.49 136.32 58.01 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 175.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.414 ' HA ' ' HD2' ' A' ' 56' ' ' PRO . 0.8 OUTLIER -80.99 108.53 10.45 Favored Pre-proline 0 C--N 1.323 -0.562 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -172.253 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.414 ' HD2' ' HA ' ' A' ' 55' ' ' CYS . 27.5 Cg_endo -61.45 -20.95 70.52 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.468 2.112 . . . . 0.0 112.084 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.506 HD21 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -70.86 -12.08 61.33 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.724 -178.332 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -64.43 -12.99 48.96 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.234 0.54 . . . . 0.0 110.264 176.241 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.406 ' C ' ' SD ' ' A' ' 59' ' ' MET . 1.2 tmt? -80.75 -28.46 36.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.538 176.569 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -153.31 102.85 2.64 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.959 -176.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 73.9 m . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.608 -0.71 . . . . 0.0 109.912 176.129 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 . . . . . 0 N--CA 1.48 1.049 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.4 p-10 -90.87 140.14 30.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.911 0.386 . . . . 0.0 110.839 -178.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 35.2 t -77.63 79.45 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 177.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.1 p -104.89 106.48 16.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.922 -177.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -132.97 133.33 43.02 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.921 177.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.6 tp60 -69.91 145.94 51.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.126 0.489 . . . . 0.0 110.94 -178.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 28.8 p-10 -117.87 155.64 29.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.305 0.574 . . . . 0.0 110.482 177.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 17.4 t -90.8 109.69 36.44 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.225 176.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.499 ' HG2' ' HG ' ' A' ' 57' ' ' LEU . 20.6 Cg_exo -64.75 -25.72 60.83 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.387 2.058 . . . . 0.0 111.775 179.772 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.477 HD11 HD11 ' A' ' 57' ' ' LEU . 10.3 mm -62.81 -28.03 44.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 115.179 -0.919 . . . . 0.0 111.591 -173.565 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.1 p -155.59 12.1 0.33 Allowed 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 111.588 0.218 . . . . 0.0 111.588 -178.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 76.1 mt 52.37 79.56 0.11 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 122.838 0.455 . . . . 0.0 111.65 -177.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -144.32 167.6 22.06 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.227 -177.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -73.95 132.07 42.07 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.783 -177.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.9 mt -137.64 126.18 33.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 C-N-CA 122.927 0.491 . . . . 0.0 109.774 174.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 66.2 m170 -116.29 -172.46 2.18 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.941 0.401 . . . . 0.0 111.231 -178.188 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.9 t -61.24 -17.66 54.44 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.676 -176.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.3 t -59.8 99.51 0.07 Allowed 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.994 0.426 . . . . 0.0 111.101 -177.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.406 ' C ' ' HD2' ' A' ' 28' ' ' ARG . 0.7 OUTLIER -88.81 -1.92 58.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.435 178.2 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.3 p -89.95 -38.44 11.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.391 179.141 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 93.8 t -75.28 -54.94 12.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 175.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -86.85 137.37 32.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.161 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.9 t60 -73.96 134.1 43.09 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -179.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 9.0 p -96.14 121.89 47.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-O 121.267 0.556 . . . . 0.0 111.113 -178.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.58 HD11 ' HB2' ' A' ' 38' ' ' HIS . 86.1 mt -70.58 155.87 92.76 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.445 175.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -65.3 -15.73 51.32 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 122.341 2.027 . . . . 0.0 111.813 178.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 46.5 t -93.63 8.42 40.92 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.334 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 83.32 23.66 53.72 Favored Glycine 0 C--N 1.336 0.548 0 CA-C-N 116.006 -0.543 . . . . 0.0 114.056 172.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.58 ' HB2' HD11 ' A' ' 34' ' ' LEU . 44.9 m-70 -103.81 155.57 18.5 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 117.303 0.551 . . . . 0.0 110.271 175.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 61.3 mt -113.49 138.22 50.43 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.443 176.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.523 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -156.75 149.29 23.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.82 175.648 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.43 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -68.58 168.92 12.0 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.06 179.73 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.46 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 8.3 mmt180 -53.05 -60.73 2.92 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.651 -168.564 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 28.8 m -61.73 -43.8 98.16 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.992 0.425 . . . . 0.0 110.856 -178.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.43 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.5 OUTLIER -61.84 -26.47 68.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.2 -178.374 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.523 ' HB2' HD13 ' A' ' 40' ' ' LEU . 48.3 t80 -62.17 -49.51 75.55 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.214 0.53 . . . . 0.0 109.578 173.34 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -59.64 -46.56 88.62 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.188 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -56.63 -56.16 24.86 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.882 -175.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 15.4 ttp -64.96 -47.03 79.08 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.256 0.55 . . . . 0.0 110.47 -175.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 61.6 tp -66.42 -28.84 68.93 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.834 -177.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -65.21 -46.41 80.81 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.961 0.41 . . . . 0.0 110.586 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.457 ' HB2' ' CD1' ' A' ' 53' ' ' TYR . 14.1 mm-40 -65.52 -23.81 66.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.802 -177.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 63.18 43.13 99.07 Favored Glycine 0 C--N 1.331 0.27 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.832 176.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.457 ' CD1' ' HB2' ' A' ' 51' ' ' GLU . 3.3 p90 -118.16 161.34 20.02 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.417 ' CD ' ' H ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -55.75 137.48 49.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.269 0.557 . . . . 0.0 111.107 179.803 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -63.39 115.67 19.85 Favored Pre-proline 0 CA--C 1.535 0.387 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.671 -171.495 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.708 ' HA ' ' SD ' ' A' ' 59' ' ' MET . 41.2 Cg_endo -66.46 -12.4 35.57 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 122.895 2.397 . . . . 0.0 112.356 -179.431 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.575 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.4 mp -79.28 -8.23 58.9 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 110.295 -0.261 . . . . 0.0 110.295 178.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -73.79 -48.54 30.81 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.894 0.378 . . . . 0.0 110.247 176.492 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.708 ' SD ' ' HA ' ' A' ' 56' ' ' PRO . 1.4 pmm? -90.83 -17.43 26.59 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.374 177.775 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 19.1 t-80 64.49 121.11 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.969 176.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 68.3 m . . . . . 0 C--O 1.25 1.085 0 CA-C-O 119.004 -0.522 . . . . 0.0 109.807 174.815 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 39.6 p30 . . . . . 0 C--O 1.231 0.12 0 N-CA-C 109.649 -0.501 . . . . 0.0 109.649 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.451 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 26.2 t -93.18 108.48 33.23 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.375 175.615 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -72.94 -16.95 25.64 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.246 1.964 . . . . 0.0 111.422 177.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.476 HD11 HD11 ' A' ' 57' ' ' LEU . 16.8 mm -63.18 -23.31 32.96 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.972 -177.786 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.464 ' SG ' ' HG3' ' A' ' 22' ' ' GLU . 21.7 p -161.69 18.15 0.1 Allowed 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -179.023 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 89.1 mt 59.36 35.22 23.09 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 176.769 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.464 ' HG3' ' SG ' ' A' ' 20' ' ' CYS . 38.6 mt-10 -103.94 -175.89 2.93 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 175.683 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -80.52 162.62 24.25 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.643 178.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.588 HD11 ' HA ' ' A' ' 40' ' ' LEU . 0.3 OUTLIER -160.77 153.49 4.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 122.909 0.483 . . . . 0.0 110.008 176.435 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.401 ' CD2' ' HB3' ' A' ' 27' ' ' SER . 9.0 p-80 -146.42 164.16 33.35 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.31 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.3 p -64.91 -24.18 67.45 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 -171.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.416 ' OG ' HG12 ' A' ' 29' ' ' VAL . 32.9 t -59.17 112.82 1.85 Allowed 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.037 0.446 . . . . 0.0 110.668 179.25 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.734 ' HD3' ' H ' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -100.38 16.61 23.9 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.542 -174.63 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.573 HG13 HG23 ' A' ' 30' ' ' VAL . 7.2 p -76.18 -35.59 28.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.155 0.502 . . . . 0.0 109.677 173.511 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.573 HG23 HG13 ' A' ' 29' ' ' VAL . 57.4 t -97.19 -46.88 12.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.072 176.674 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.11 123.22 26.61 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.437 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -73.67 138.69 44.9 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 21.7 t -89.15 119.89 36.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.793 -178.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.569 HD12 ' HB2' ' A' ' 38' ' ' HIS . 76.6 mt -68.91 152.16 96.92 Favored Pre-proline 0 C--N 1.328 -0.338 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 169.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -66.61 -8.85 22.29 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.286 1.99 . . . . 0.0 112.238 -177.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 42.7 t -100.11 9.97 42.0 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.327 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.52 8.84 63.66 Favored Glycine 0 C--N 1.338 0.679 0 N-CA-C 114.663 0.625 . . . . 0.0 114.663 169.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.582 ' HB3' HD22 ' A' ' 57' ' ' LEU . 62.7 m-70 -94.81 156.89 16.17 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 117.553 0.677 . . . . 0.0 111.079 -178.72 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.4 mt -113.28 143.06 45.06 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.18 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.588 ' HA ' HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -158.29 142.27 15.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.682 174.986 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.407 ' ND1' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -55.77 154.62 6.78 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.573 0.225 . . . . 0.0 110.602 175.693 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.447 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 15.5 mmt180 -47.8 -54.92 10.9 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.535 -170.395 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.43 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 92.5 m -56.27 -41.09 75.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.069 0.461 . . . . 0.0 111.121 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.449 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 0.0 OUTLIER -70.5 -25.48 63.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.966 -177.588 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.512 ' HB2' HD13 ' A' ' 40' ' ' LEU . 45.5 t80 -62.2 -42.65 99.49 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 173.757 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.457 ' O ' ' HG3' ' A' ' 50' ' ' LYS . 36.7 mt-10 -65.56 -49.23 69.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.584 176.233 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.489 ' HA ' ' HD3' ' A' ' 50' ' ' LYS . 42.4 mt-10 -54.66 -48.19 72.64 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.334 -178.562 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.476 ' C ' ' SD ' ' A' ' 48' ' ' MET . 0.5 OUTLIER -68.33 -51.9 39.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.493 -177.658 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 53.3 tp -61.83 -28.52 69.54 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.923 -176.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.489 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 9.6 mtpm? -53.68 -50.07 66.62 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.152 0.501 . . . . 0.0 110.42 173.355 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.442 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 7.4 mm-40 -76.14 -44.46 38.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.031 -176.147 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 69.75 22.78 76.95 Favored Glycine 0 C--N 1.333 0.364 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.641 -176.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.442 ' HD1' ' HB2' ' A' ' 51' ' ' GLU . 5.7 p90 -75.67 170.81 15.45 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 122.732 0.413 . . . . 0.0 111.2 -175.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -60.72 124.68 21.14 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.932 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.6 p -65.22 110.13 3.87 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -176.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -67.52 -26.33 40.39 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.636 2.224 . . . . 0.0 112.088 -176.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.582 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -61.63 -17.63 56.1 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 120.871 0.367 . . . . 0.0 110.72 -177.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.47 0.532 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.214 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 . . . . . 0 C--O 1.233 0.215 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.46 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 27.2 t -72.48 109.34 5.76 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.606 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.65 -15.46 21.66 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.297 1.998 . . . . 0.0 111.353 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.46 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 26.7 mm -63.24 -23.47 33.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.204 -177.453 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 29.5 p -157.1 12.12 0.23 Allowed 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -179.19 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 88.2 mt 53.72 69.53 0.7 Allowed 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.326 0.584 . . . . 0.0 110.759 -175.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -146.09 146.06 30.77 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.188 -0.914 . . . . 0.0 108.856 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -67.58 162.57 23.16 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -176.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.7 tt -145.76 146.77 19.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.843 0.354 . . . . 0.0 110.583 -176.804 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -93.45 144.66 25.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.044 178.468 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 15.4 t -75.59 -18.32 59.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.889 0.376 . . . . 0.0 110.522 178.267 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.413 ' O ' HG12 ' A' ' 30' ' ' VAL . 9.0 t -63.5 117.67 7.07 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.092 178.292 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 67.6 ttt-85 -63.7 -31.27 72.39 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.508 -176.316 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.409 HG12 ' OG ' ' A' ' 27' ' ' SER . 12.4 p -60.83 -22.75 27.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -174.596 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.413 HG12 ' O ' ' A' ' 27' ' ' SER . 7.0 p -106.79 2.53 10.1 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-O 120.888 0.375 . . . . 0.0 111.702 -174.669 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -138.02 164.84 28.07 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.993 0.425 . . . . 0.0 111.068 -177.294 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 42.4 t-80 -100.41 135.61 41.57 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 174.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 48.8 t -95.21 122.33 46.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.609 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.664 HD12 ' HB2' ' A' ' 38' ' ' HIS . 71.1 mt -72.09 153.2 92.68 Favored Pre-proline 0 C--N 1.325 -0.495 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 173.534 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -63.49 -17.31 59.45 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.577 2.184 . . . . 0.0 111.746 -178.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.4 t -93.5 7.96 42.55 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.504 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.51 23.7 46.06 Favored Glycine 0 C--N 1.337 0.634 0 CA-C-N 116.257 -0.429 . . . . 0.0 113.668 172.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.664 ' HB2' HD12 ' A' ' 34' ' ' LEU . 43.5 m-70 -103.5 156.99 17.35 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 122.595 -0.356 . . . . 0.0 111.175 178.085 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 44.4 mt -111.11 142.94 42.62 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.879 177.343 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.493 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -160.63 145.3 14.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.821 173.089 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.559 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -58.88 162.27 4.26 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.68 0.276 . . . . 0.0 110.687 176.478 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.491 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 24.4 mmt180 -50.4 -57.12 8.71 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.811 -169.044 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 24.8 p -59.44 -49.04 79.35 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.39 -177.622 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.559 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -59.22 -27.95 66.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.56 -176.456 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.493 ' HB2' HD13 ' A' ' 40' ' ' LEU . 31.5 t80 -55.3 -53.64 53.63 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.611 0.72 . . . . 0.0 109.783 174.435 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.493 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 6.4 mm-40 -69.66 -37.66 76.81 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.542 -1.208 . . . . 0.0 110.57 -177.902 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -62.56 -41.16 98.74 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.53 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 19.5 ttp -75.19 -50.39 16.38 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.026 0.441 . . . . 0.0 110.155 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 48.8 tp -61.55 -28.71 69.53 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.425 -177.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.493 ' HB2' ' O ' ' A' ' 46' ' ' GLU . 22.7 ttmm -57.96 -45.18 87.08 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.076 176.421 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.9 mm-40 -74.4 -40.81 61.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.158 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 65.19 46.22 88.45 Favored Glycine 0 N--CA 1.451 -0.317 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.374 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 20.8 p90 -104.49 -179.51 3.97 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -64.14 120.17 11.58 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.882 -177.252 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.6 p -54.59 108.24 1.09 Allowed Pre-proline 0 C--O 1.235 0.315 0 CA-C-O 120.77 0.319 . . . . 0.0 111.845 -178.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -65.16 -19.19 62.78 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 122.784 2.323 . . . . 0.0 112.422 -174.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.585 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -71.59 -11.27 60.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.989 0.423 . . . . 0.0 110.323 -179.343 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.466 0.341 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.901 173.087 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 120.891 0.377 . . . . 0.0 110.269 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.57 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 42.8 t -97.74 111.06 57.89 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.641 -177.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.424 ' HG2' ' HG ' ' A' ' 57' ' ' LEU . 72.0 Cg_endo -77.5 -12.34 16.94 Favored 'Trans proline' 0 CA--C 1.534 0.504 0 C-N-CA 122.259 1.973 . . . . 0.0 112.129 175.111 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.57 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 29.0 mm -59.85 -44.47 94.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-O 120.794 0.331 . . . . 0.0 110.808 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.562 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 27.8 p -132.0 15.72 4.7 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.539 -177.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 51.8 mt 52.41 72.28 0.41 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 121.28 0.562 . . . . 0.0 109.591 -175.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.562 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 21.1 tt0 -146.13 -176.45 5.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.311 -171.458 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.496 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 16.0 t70 -86.82 156.35 19.92 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 122.543 0.337 . . . . 0.0 111.308 178.725 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.559 HG13 ' HB2' ' A' ' 17' ' ' CYS . 8.5 mt -148.87 105.1 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 169.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -76.1 136.65 39.85 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.535 -0.542 . . . . 0.0 109.535 172.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.7 m -52.81 -17.69 1.5 Allowed 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -171.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.6 m -52.35 106.42 0.15 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 120.857 0.36 . . . . 0.0 111.338 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -62.61 -24.39 67.56 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.111 -178.286 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.7 t -53.54 -30.67 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-O 121.079 0.466 . . . . 0.0 110.955 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 60.6 t -106.26 -47.09 8.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.452 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.57 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -79.55 107.0 11.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.703 -178.107 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.597 ' HB2' HH11 ' A' ' 42' ' ' ARG . 9.4 t60 -69.1 134.99 50.08 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.211 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.2 t -87.15 115.2 27.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.249 -178.263 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.651 HD12 ' HB2' ' A' ' 38' ' ' HIS . 43.0 mt -72.01 147.82 91.37 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.99 170.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -55.61 -24.64 46.18 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.818 2.345 . . . . 0.0 112.498 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.9 t -88.72 5.92 41.06 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.761 -177.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.24 23.66 33.9 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 121.315 -0.469 . . . . 0.0 113.54 173.299 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.651 ' HB2' HD12 ' A' ' 34' ' ' LEU . 70.3 m-70 -102.89 155.61 18.23 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.9 0.35 . . . . 0.0 111.013 178.026 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.57 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 81.1 mt -115.71 136.93 52.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.343 175.778 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.584 HD21 HD11 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -160.26 146.36 15.44 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.747 0.308 . . . . 0.0 111.101 175.222 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.549 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -58.91 157.65 9.51 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.223 178.39 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.597 HH11 ' HB2' ' A' ' 32' ' ' HIS . 26.2 mmt180 -46.57 -58.37 3.87 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.567 -171.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.445 ' O ' ' HG2' ' A' ' 47' ' ' GLU . 28.4 m -57.65 -48.26 79.98 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.003 0.43 . . . . 0.0 110.93 -177.499 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.549 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -61.01 -28.74 69.26 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.921 -179.214 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.559 ' HB2' HD13 ' A' ' 40' ' ' LEU . 39.6 t80 -65.16 -55.29 19.49 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.501 177.895 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -61.5 -48.22 82.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.265 -175.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 43' ' ' THR . 48.6 mm-40 -59.69 -45.48 91.95 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -175.804 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 18.9 ttp -65.87 -44.99 83.73 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.029 0.442 . . . . 0.0 110.053 -179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 42.8 tp -68.89 -28.15 66.43 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.766 -179.135 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.443 ' HE2' ' HB3' ' A' ' 50' ' ' LYS . 4.7 tmmm? -68.45 -33.85 74.92 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.049 179.352 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -76.98 -56.23 4.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.593 173.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 91.0 14.68 57.44 Favored Glycine 0 C--N 1.332 0.314 0 CA-C-N 115.842 -0.617 . . . . 0.0 113.334 175.561 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 21.9 p90 -75.38 173.55 10.77 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 117.007 0.404 . . . . 0.0 110.333 177.554 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 -56.7 128.03 34.42 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.551 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.2 p -54.26 109.62 1.64 Allowed Pre-proline 0 C--O 1.235 0.306 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.546 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.459 ' HG2' HD13 ' A' ' 19' ' ' ILE . 23.9 Cg_endo -60.78 -25.93 82.06 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.729 2.286 . . . . 0.0 112.658 -175.301 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.571 HD22 ' HB3' ' A' ' 38' ' ' HIS . 3.9 mp -65.46 -15.68 62.88 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 120.902 0.382 . . . . 0.0 110.967 -177.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.465 0.288 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.581 176.755 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 34.8 p30 . . . . . 0 C--O 1.233 0.189 0 CA-C-O 121.021 0.439 . . . . 0.0 110.391 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.605 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 35.5 t -99.11 109.29 53.72 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.333 -177.309 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -74.24 -16.56 22.21 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.451 2.101 . . . . 0.0 111.557 175.054 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.605 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 34.4 mm -61.03 -25.89 37.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.022 -179.048 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 27.6 p -156.7 18.4 0.32 Allowed 'General case' 0 N--CA 1.466 0.349 0 O-C-N 122.41 -0.181 . . . . 0.0 111.335 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 80.2 mt 56.27 39.88 30.07 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.916 0.388 . . . . 0.0 111.507 177.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -118.29 174.33 6.29 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.183 -178.243 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -67.69 153.51 43.54 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.357 -175.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.514 HD11 ' HA ' ' A' ' 40' ' ' LEU . 1.8 mt -153.87 146.16 14.19 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 CA-C-N 115.287 -0.87 . . . . 0.0 108.986 171.435 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 24.0 m80 -149.25 -170.14 3.55 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 122.328 0.251 . . . . 0.0 110.564 178.47 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.487 ' O ' ' HD2' ' A' ' 28' ' ' ARG . 51.7 p -62.99 -17.55 62.26 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -173.338 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.5 m -57.54 99.45 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 111.536 0.199 . . . . 0.0 111.536 -178.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.52 ' HD2' ' H ' ' A' ' 28' ' ' ARG . 5.2 mpt_? -71.57 -28.73 64.04 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.191 0.52 . . . . 0.0 110.134 178.62 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 46.7 t -62.67 -38.14 80.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.079 177.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.538 ' O ' ' HA ' ' A' ' 41' ' ' HIS . 60.9 t -82.32 -62.62 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.85 -0.613 . . . . 0.0 109.658 176.398 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.527 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -85.69 98.72 10.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.491 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -61.98 143.45 56.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.34 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 40.2 t -86.89 115.58 27.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.363 -177.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.643 HD12 ' HB2' ' A' ' 38' ' ' HIS . 32.2 mt -67.39 151.79 96.81 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.812 173.422 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -59.15 -19.02 47.29 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.87 2.38 . . . . 0.0 111.896 174.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 32.5 t -99.51 18.17 18.55 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.501 -178.646 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.91 15.19 79.62 Favored Glycine 0 C--N 1.338 0.666 0 N-CA-C 114.706 0.642 . . . . 0.0 114.706 169.362 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.645 ' HB3' HD22 ' A' ' 57' ' ' LEU . 36.3 m-70 -103.0 157.39 17.01 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 117.58 0.69 . . . . 0.0 111.041 178.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.527 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 97.6 mt -108.57 138.54 44.71 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.849 177.439 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.537 HD21 HD11 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -158.91 138.9 12.04 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 122.83 0.452 . . . . 0.0 110.482 174.125 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.538 ' HA ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -56.46 163.5 1.72 Allowed 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.674 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.407 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 18.6 mmt180 -43.15 -64.72 0.58 Allowed 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 114.884 -1.053 . . . . 0.0 112.551 -173.815 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 24.3 p -56.56 -47.47 79.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.114 0.483 . . . . 0.0 110.923 -177.01 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.489 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.5 OUTLIER -61.98 -28.75 69.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.232 -179.671 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.522 ' HB2' HD13 ' A' ' 40' ' ' LEU . 53.5 t80 -68.63 -53.14 24.42 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.047 0.451 . . . . 0.0 110.034 176.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -62.28 -45.07 94.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.741 -177.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.1 mm-40 -59.85 -54.52 45.28 Favored 'General case' 0 C--O 1.234 0.261 0 O-C-N 123.129 0.268 . . . . 0.0 111.609 178.67 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.471 ' HA ' ' CE1' ' A' ' 53' ' ' TYR . 6.8 ttp -58.94 -40.79 85.72 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.131 0.491 . . . . 0.0 110.175 -176.776 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.1 tp -75.85 -29.91 58.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.875 -178.415 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 50.1 tttm -65.51 -51.11 62.34 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.257 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -71.24 -31.45 67.56 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.932 174.056 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 62.38 38.59 96.52 Favored Glycine 0 N--CA 1.452 -0.28 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.458 177.537 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.471 ' CE1' ' HA ' ' A' ' 48' ' ' MET . 41.1 p90 -88.12 -175.95 5.24 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.786 0.327 . . . . 0.0 110.634 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.847 ' H ' ' HD2' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -75.22 144.77 42.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.355 -173.951 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.5 p -84.27 107.09 9.69 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.805 -178.392 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -67.23 -13.52 39.82 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 122.516 2.144 . . . . 0.0 111.811 179.085 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.645 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -74.99 -6.75 51.02 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.44 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.465 0.303 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 173.722 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.454 -0.226 0 CA-C-O 121.024 0.44 . . . . 0.0 109.981 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.526 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 10.6 t -90.38 108.99 30.54 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.805 -176.749 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -68.96 -11.37 31.66 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.256 1.971 . . . . 0.0 112.041 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.526 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 26.5 mm -71.87 -21.1 20.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.875 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.417 ' SG ' ' CG ' ' A' ' 22' ' ' GLU . 21.8 p -164.12 17.49 0.06 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 120.944 -0.303 . . . . 0.0 111.776 -179.483 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.419 ' N ' ' O ' ' A' ' 17' ' ' CYS . 60.1 mt 53.67 31.08 12.06 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.417 ' CG ' ' SG ' ' A' ' 20' ' ' CYS . 56.4 mm-40 -101.97 -177.59 3.46 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.23 178.639 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -74.75 148.4 40.47 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -174.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.512 HD11 ' HA ' ' A' ' 40' ' ' LEU . 4.5 mt -149.72 124.0 1.68 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 C-N-CA 123.38 0.672 . . . . 0.0 109.924 170.862 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 18.1 t-80 -108.5 157.82 18.1 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 177.145 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.3 p -54.06 -22.48 10.87 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 9.6 m -61.94 100.51 0.16 Allowed 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.018 0.437 . . . . 0.0 110.555 177.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.9 ppt_? -81.18 16.81 1.43 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.532 -176.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 56.4 t -71.21 -47.63 59.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 172.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.419 ' O ' ' HA ' ' A' ' 41' ' ' HIS . 7.8 p -86.1 -38.4 12.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.199 175.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.511 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -86.76 101.86 13.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.67 -179.023 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -59.52 137.14 58.11 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.362 178.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 30.6 t -86.25 108.81 18.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.593 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.677 HD12 ' HB2' ' A' ' 38' ' ' HIS . 43.2 mt -66.9 151.04 97.4 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.286 173.519 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.4 -24.59 69.42 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.726 2.284 . . . . 0.0 112.237 179.495 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 43.0 t -91.13 7.73 39.15 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.65 -177.471 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.98 22.54 45.11 Favored Glycine 0 C--N 1.337 0.588 0 CA-C-N 116.103 -0.499 . . . . 0.0 113.872 172.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.677 ' HB2' HD12 ' A' ' 34' ' ' LEU . 78.0 m-70 -101.64 155.94 17.8 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 117.263 0.531 . . . . 0.0 110.784 177.07 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.511 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 71.0 mt -115.75 136.38 53.11 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.558 177.066 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.593 HD21 HD11 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -161.19 140.31 10.19 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.005 175.368 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.583 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -53.65 153.09 4.62 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.604 0.24 . . . . 0.0 111.518 179.354 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.477 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 15.3 mmt180 -44.24 -57.04 3.69 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.941 0.897 . . . . 0.0 112.203 -172.849 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.456 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 61.1 m -52.7 -49.35 65.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.04 -178.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.583 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -65.1 -30.87 71.85 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.029 -177.914 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.509 ' HB2' HD13 ' A' ' 40' ' ' LEU . 13.3 t80 -60.88 -50.31 73.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.98 175.817 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.471 ' O ' ' HG3' ' A' ' 50' ' ' LYS . 47.6 mt-10 -64.87 -41.43 95.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.592 -179.239 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 43' ' ' THR . 43.8 mt-10 -55.65 -55.36 33.05 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.998 0.428 . . . . 0.0 110.835 177.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 15.6 ttp -65.49 -40.92 93.63 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.918 -175.553 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 34.9 tp -73.84 -28.76 61.76 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.552 -173.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.471 ' HG3' ' O ' ' A' ' 46' ' ' GLU . 56.5 mttp -57.26 -47.73 80.68 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.104 0.478 . . . . 0.0 110.049 175.504 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -70.27 -39.18 75.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.61 173.188 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 64.63 19.76 65.3 Favored Glycine 0 N--CA 1.45 -0.416 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.257 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.2 p90 -70.75 173.94 6.62 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 120.761 0.315 . . . . 0.0 110.651 -177.767 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 67.9 mtt180 -65.04 122.9 18.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.532 -175.612 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.423 ' HA ' ' HD2' ' A' ' 56' ' ' PRO . 1.4 p -54.12 112.46 3.88 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.772 -173.486 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' ' 55' ' ' CYS . 34.3 Cg_endo -63.73 -24.86 68.68 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.73 2.287 . . . . 0.0 112.332 -178.624 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.57 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.6 mp -66.65 -14.42 62.44 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 120.762 0.315 . . . . 0.0 110.823 -178.158 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.467 0.375 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.976 174.113 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.1 p30 . . . . . 0 C--O 1.232 0.135 0 CA-C-O 121.226 0.536 . . . . 0.0 110.568 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.556 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 11.1 t -82.37 108.45 11.86 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.63 177.193 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.85 -11.52 29.53 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.171 1.914 . . . . 0.0 111.539 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.556 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 21.0 mm -69.5 -25.81 29.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.684 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.803 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 17.4 p -165.21 22.77 0.05 Allowed 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -177.025 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 90.9 mt 59.03 24.71 12.99 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 176.593 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.803 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 0.3 OUTLIER -97.33 171.21 8.56 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 -177.515 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -76.34 150.75 36.84 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.977 0.417 . . . . 0.0 111.239 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.467 HD13 ' O ' ' A' ' 39' ' ' LEU . 7.4 mt -144.12 121.9 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.261 172.77 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 -105.05 159.71 15.61 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.933 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.541 ' O ' ' HD3' ' A' ' 28' ' ' ARG . 0.9 OUTLIER -59.33 -17.5 29.99 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -177.714 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.3 m -59.63 104.89 0.31 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.631 -0.259 . . . . 0.0 111.687 -177.585 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.541 ' HD3' ' O ' ' A' ' 26' ' ' THR . 1.7 mpp_? -66.88 -14.61 62.93 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.776 0.322 . . . . 0.0 110.683 176.855 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 58.4 t -69.99 -33.22 54.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.554 176.518 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 59.2 t -98.24 -50.58 11.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.275 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.516 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -93.09 113.29 25.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.254 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -62.16 128.29 35.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.739 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.413 ' HA ' HD23 ' A' ' 39' ' ' LEU . 7.2 p -83.66 121.52 36.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.269 0.557 . . . . 0.0 111.337 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.62 HD12 ' HB2' ' A' ' 38' ' ' HIS . 94.9 mt -73.05 154.34 90.72 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.647 174.692 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -62.64 -9.99 17.96 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.779 2.319 . . . . 0.0 112.251 178.193 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.8 t -107.23 17.46 22.88 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.207 0.527 . . . . 0.0 109.847 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.56 -14.89 63.75 Favored Glycine 0 C--N 1.341 0.84 0 N-CA-C 114.966 0.746 . . . . 0.0 114.966 168.184 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.62 ' HB2' HD12 ' A' ' 34' ' ' LEU . 14.2 m-70 -81.78 156.7 24.8 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 117.572 0.686 . . . . 0.0 111.385 -173.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.516 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 97.5 mt -109.65 145.27 36.77 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.282 177.004 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.513 HD21 HD11 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -157.96 152.43 24.73 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 174.047 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.45 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -70.59 171.81 9.64 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.76 0.314 . . . . 0.0 111.379 -179.577 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.476 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 12.3 mmm180 -46.48 -67.25 0.3 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.775 -173.621 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 22.3 m -60.71 -43.86 97.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.06 0.457 . . . . 0.0 110.681 -175.546 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.45 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.6 OUTLIER -63.68 -23.94 67.58 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.586 -176.27 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.512 ' HB2' HD13 ' A' ' 40' ' ' LEU . 34.4 t80 -61.4 -50.3 73.42 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 173.61 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.412 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 49.0 mt-10 -67.67 -41.21 84.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.721 -179.126 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -56.62 -51.03 70.23 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.489 -177.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 13.6 ttp -70.18 -49.52 49.55 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.933 0.397 . . . . 0.0 110.656 -177.462 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.4 tp -62.2 -34.77 77.1 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.913 -176.56 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 46' ' ' GLU . 38.6 ttmt -55.06 -48.04 74.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.286 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -68.9 -43.9 74.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.208 177.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.78 18.89 79.42 Favored Glycine 0 CA--C 1.519 0.287 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.861 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.439 ' CE2' ' HD3' ' A' ' 56' ' ' PRO . 13.7 p90 -79.06 176.9 9.23 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 178.243 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 79.2 mtp180 -62.41 119.47 9.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.613 0.244 . . . . 0.0 110.353 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.487 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 0.5 OUTLIER -51.37 113.87 4.41 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.51 178.426 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.439 ' HD3' ' CE2' ' A' ' 53' ' ' TYR . 35.0 Cg_endo -63.78 -17.59 60.51 Favored 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 122.519 2.146 . . . . 0.0 111.534 -178.508 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.496 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.8 mp -75.92 -2.66 31.35 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.143 179.074 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.463 0.223 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 171.461 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.522 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 32.6 m-80 . . . . . 0 CA--C 1.519 -0.221 0 CA-C-O 120.932 0.396 . . . . 0.0 110.723 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.572 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 12.8 t -71.2 110.23 6.93 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.518 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.522 ' HD3' ' O ' ' A' ' 16' ' ' ASN . 5.0 Cg_exo -75.06 -13.44 21.28 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.547 2.164 . . . . 0.0 110.864 174.352 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.572 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 11.9 mm -66.0 -27.0 39.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.856 -176.522 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.444 ' SG ' ' OE2' ' A' ' 22' ' ' GLU . 18.3 p -165.15 20.41 0.05 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 111.672 0.249 . . . . 0.0 111.672 -178.664 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 90.8 mt 55.73 89.65 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.81 0.338 . . . . 0.0 111.186 -177.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.444 ' OE2' ' SG ' ' A' ' 20' ' ' CYS . 26.6 mt-10 -157.09 171.86 19.7 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.651 -179.571 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -83.3 145.62 28.99 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.996 175.341 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 34.2 mt -138.75 111.73 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.34 173.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -80.35 150.92 29.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.683 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 16.3 p -57.74 -17.87 17.96 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -177.379 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.4 m -66.3 97.21 0.39 Allowed 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.735 0.302 . . . . 0.0 110.934 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.652 ' HD3' ' H ' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -78.09 11.41 2.31 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.101 0.477 . . . . 0.0 111.344 -179.046 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 37.4 t -74.39 -45.36 46.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 172.442 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.6 p -87.58 -44.81 16.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.052 178.064 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.85 112.89 18.65 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.233 -0.439 . . . . 0.0 109.946 177.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.403 ' O ' HD12 ' A' ' 40' ' ' LEU . 19.2 t60 -61.08 131.02 49.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.298 -178.78 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.43 ' HA ' HD23 ' A' ' 39' ' ' LEU . 7.3 p -86.36 120.61 36.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.017 179.226 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.6 HD12 ' HB2' ' A' ' 38' ' ' HIS . 76.2 mt -74.86 153.37 86.96 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.074 173.26 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.5 -18.13 58.91 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.295 1.996 . . . . 0.0 111.674 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 37.0 t -90.76 9.03 31.67 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.328 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.18 19.21 57.79 Favored Glycine 0 C--N 1.338 0.666 0 CA-C-N 116.112 -0.495 . . . . 0.0 114.127 171.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.6 ' HB2' HD12 ' A' ' 34' ' ' LEU . 61.2 m-70 -104.18 157.15 17.32 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 117.4 0.6 . . . . 0.0 111.1 177.686 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' A' ' 33' ' ' VAL . 93.5 mt -113.52 143.93 43.7 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.358 175.32 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.558 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -159.18 148.02 18.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.477 175.615 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.561 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.1 OUTLIER -58.25 151.76 18.71 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.446 175.858 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.472 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 17.5 mmt85 -47.84 -57.44 5.64 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.842 0.714 . . . . 0.0 112.092 -170.108 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.441 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 20.2 m -53.63 -40.43 65.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.171 0.51 . . . . 0.0 111.387 -178.289 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.561 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -72.14 -25.35 61.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.999 -176.058 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.558 ' HB2' HD13 ' A' ' 40' ' ' LEU . 20.5 t80 -61.2 -46.64 89.62 Favored 'General case' 0 C--O 1.232 0.143 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 173.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.73 -51.0 71.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.288 176.812 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 43' ' ' THR . 42.4 mt-10 -54.65 -55.87 25.03 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.615 -177.085 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 10.1 ttp -63.35 -44.95 93.38 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.777 -175.665 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 64.9 tp -64.09 -34.02 77.09 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.649 -177.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.424 ' NZ ' ' HB3' ' A' ' 50' ' ' LYS . 8.8 mtpm? -67.86 -50.23 57.65 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.972 0.415 . . . . 0.0 110.658 176.554 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -63.61 -29.35 70.61 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.85 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 60.93 23.71 61.79 Favored Glycine 0 C--N 1.332 0.319 0 CA-C-N 115.829 -0.623 . . . . 0.0 113.328 174.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -85.8 169.21 13.58 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 110.333 -0.247 . . . . 0.0 110.333 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 38.0 mmt180 -58.1 127.22 30.99 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.709 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 1.2 p -60.79 106.33 0.76 Allowed Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.214 178.285 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -65.93 -18.08 56.75 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.714 2.276 . . . . 0.0 112.272 -174.196 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.573 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.7 mp -68.76 -17.3 64.02 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.153 178.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.7 OUTLIER . . . . . 0 N--CA 1.468 0.465 0 CA-C-O 120.991 0.425 . . . . 0.0 110.422 174.23 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.1 p30 . . . . . 0 C--O 1.233 0.197 0 CA-C-O 121.112 0.482 . . . . 0.0 109.865 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.453 ' HB2' HG13 ' A' ' 24' ' ' ILE . 33.3 t -85.98 111.09 35.67 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.793 -178.203 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.506 ' HG2' ' HG ' ' A' ' 57' ' ' LEU . 17.2 Cg_exo -64.91 -19.01 63.9 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.353 2.036 . . . . 0.0 111.398 179.268 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.473 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 11.7 mm -76.65 -12.41 14.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.812 -173.328 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.451 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 20.2 p -171.68 19.36 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 77.9 mt 60.08 16.35 5.86 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 176.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.451 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 27.6 mm-40 -97.0 173.28 7.36 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.564 0.221 . . . . 0.0 111.105 -177.016 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -69.83 153.52 43.2 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 116.172 -0.467 . . . . 0.0 112.087 -175.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.453 HG13 ' HB2' ' A' ' 17' ' ' CYS . 4.3 mt -150.32 131.53 4.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 123.558 0.743 . . . . 0.0 109.431 172.136 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 52.3 m80 -114.46 168.85 9.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.83 177.067 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 14.5 t -70.23 -17.2 63.13 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.656 -175.268 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.7 p -69.32 133.12 47.46 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.644 177.447 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.689 ' HD2' ' H ' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -97.74 11.14 38.17 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.383 -176.915 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 64.0 t -58.67 -50.05 80.49 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-O 120.954 0.407 . . . . 0.0 110.289 178.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 49.4 t -100.95 -32.77 3.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.073 177.049 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.597 ' HA ' ' HA ' ' A' ' 41' ' ' HIS . . . -86.72 104.54 16.21 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.285 -178.293 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.2 t60 -65.21 131.53 46.75 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.356 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.3 p -89.56 115.46 29.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.025 0.441 . . . . 0.0 110.743 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.632 HD12 ' HB2' ' A' ' 38' ' ' HIS . 86.6 mt -64.5 153.41 86.94 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.086 175.139 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -67.26 -10.59 29.15 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.27 1.98 . . . . 0.0 111.364 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 38.6 t -97.03 9.67 41.43 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.386 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.95 17.38 59.64 Favored Glycine 0 C--N 1.338 0.68 0 N-CA-C 114.33 0.492 . . . . 0.0 114.33 171.563 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.648 ' HB3' HD22 ' A' ' 57' ' ' LEU . 25.4 m-70 -103.84 156.08 18.11 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 117.499 0.649 . . . . 0.0 110.945 178.97 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 71.5 mt -112.9 135.92 53.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.946 0.403 . . . . 0.0 110.95 176.308 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.515 HD21 HD11 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -155.09 137.0 14.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.11 173.654 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 31' ' ' ALA . 0.0 OUTLIER -58.0 163.48 2.75 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.884 0.374 . . . . 0.0 111.934 -177.952 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.45 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 16.1 mmm180 -37.59 -69.01 0.13 Allowed 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 114.463 -1.244 . . . . 0.0 113.204 -174.301 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 53.3 m -63.22 -35.74 81.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.005 0.431 . . . . 0.0 111.292 -174.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.499 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -68.45 -24.05 64.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.175 -177.284 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.45 ' HB3' ' O ' ' A' ' 42' ' ' ARG . 30.1 t80 -60.82 -43.71 97.86 Favored 'General case' 0 C--O 1.232 0.179 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 173.191 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.454 ' HB3' ' HE2' ' A' ' 50' ' ' LYS . 41.6 mt-10 -64.43 -48.46 75.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.091 177.408 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.574 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 43.6 mt-10 -54.04 -57.01 12.65 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.501 -176.184 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 11.4 ttp -63.96 -47.72 79.31 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.064 0.459 . . . . 0.0 110.574 -175.125 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.0 tp -61.73 -38.16 86.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.284 -175.396 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.454 ' HE2' ' HB3' ' A' ' 46' ' ' GLU . 68.9 mttm -71.25 -35.37 71.4 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.57 0.224 . . . . 0.0 111.017 -179.39 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.574 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 8.1 mm-40 -59.52 -31.59 69.53 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.004 0.43 . . . . 0.0 110.487 178.053 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.59 -4.34 60.55 Favored Glycine 0 CA--C 1.518 0.261 0 CA-C-N 115.797 -0.638 . . . . 0.0 114.065 171.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -73.12 166.75 22.51 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 117.677 0.738 . . . . 0.0 110.723 179.2 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 63.3 mtm180 -65.44 135.62 55.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.246 -0.434 . . . . 0.0 109.89 177.002 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 0.9 OUTLIER -54.14 109.72 1.69 Allowed Pre-proline 0 C--N 1.327 -0.37 0 O-C-N 123.304 0.377 . . . . 0.0 112.01 -178.195 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -66.49 -17.62 53.56 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.64 2.226 . . . . 0.0 111.877 -178.526 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.648 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -70.82 -8.71 54.49 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.177 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.465 0.301 0 CA-C-O 121.292 0.568 . . . . 0.0 109.85 174.245 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.671 ' N ' HD21 ' A' ' 16' ' ' ASN . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.196 0 CA-C-O 120.945 0.403 . . . . 0.0 109.995 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.635 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 13.4 t -96.78 110.52 53.82 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.134 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -68.63 -20.82 40.22 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.188 1.925 . . . . 0.0 111.097 175.664 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.635 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 19.3 mm -63.67 -25.51 38.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.241 -177.201 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.48 ' SG ' ' CG ' ' A' ' 22' ' ' GLU . 18.7 p -166.42 25.41 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.709 0.29 . . . . 0.0 111.597 -179.336 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 61.1 mt 54.78 21.96 3.88 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 112.867 0.692 . . . . 0.0 112.867 176.158 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.48 ' CG ' ' SG ' ' A' ' 20' ' ' CYS . 35.5 mm-40 -93.17 162.58 13.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.732 0.301 . . . . 0.0 110.962 -178.32 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -62.94 151.67 38.78 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.801 -179.709 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.2 mt -148.6 124.13 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.41 173.582 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -105.07 172.03 7.01 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 110.083 -0.339 . . . . 0.0 110.083 175.3 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.4 m -71.32 -18.75 62.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.724 -174.067 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.484 ' OG ' HG12 ' A' ' 29' ' ' VAL . 20.6 t -58.23 106.81 0.41 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 120.961 0.41 . . . . 0.0 110.87 -179.45 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.5 8.21 17.27 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.212 -175.407 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.484 HG12 ' OG ' ' A' ' 27' ' ' SER . 14.6 p -81.94 -38.95 16.21 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-O 121.006 0.432 . . . . 0.0 109.836 174.701 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.4 p -94.22 -44.46 13.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.013 177.447 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -87.47 97.9 11.09 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 175.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 8.8 t60 -58.49 127.36 31.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.498 -176.491 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.1 p -81.97 114.31 22.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.134 0.493 . . . . 0.0 110.736 179.467 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.623 HD12 ' HB2' ' A' ' 38' ' ' HIS . 76.8 mt -65.17 152.8 90.79 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.147 174.433 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.44 -3.65 12.24 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.348 2.032 . . . . 0.0 111.287 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 36.1 t -105.49 10.11 33.32 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.278 178.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 87.57 16.01 60.89 Favored Glycine 0 C--N 1.339 0.706 0 N-CA-C 114.92 0.728 . . . . 0.0 114.92 170.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.624 ' HB3' HD22 ' A' ' 57' ' ' LEU . 43.8 m-70 -104.3 156.5 17.86 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 117.759 0.779 . . . . 0.0 110.84 177.828 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 95.4 mt -113.3 137.19 51.86 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 122.533 0.333 . . . . 0.0 110.717 177.102 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.523 HD21 HD11 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -156.24 141.05 17.1 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.251 174.326 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.535 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -55.72 159.34 3.08 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.915 0.388 . . . . 0.0 111.701 179.71 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.515 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 21.5 mmt85 -42.4 -66.07 0.4 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 114.856 -1.065 . . . . 0.0 112.999 -172.217 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 25.2 m -61.67 -37.91 85.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.913 0.387 . . . . 0.0 111.056 -174.267 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.535 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -66.72 -26.83 67.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.945 179.852 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.515 ' HB3' ' O ' ' A' ' 42' ' ' ARG . 38.2 t80 -63.7 -48.61 76.39 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 174.071 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -61.74 -43.78 98.19 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.171 179.033 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.556 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 79.2 mm-40 -57.93 -56.58 20.16 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.844 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 8.5 ttp -61.52 -44.56 96.84 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.097 0.475 . . . . 0.0 110.411 -175.304 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 49.2 tp -66.39 -32.02 73.15 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.297 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.3 ttpp -68.64 -42.91 77.33 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.56 177.166 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.556 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 30.2 mm-40 -65.58 -37.81 87.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.836 177.522 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 64.8 39.09 96.35 Favored Glycine 0 C--N 1.333 0.379 0 CA-C-N 115.589 -0.732 . . . . 0.0 113.132 176.064 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 6.3 p90 -106.62 177.46 4.85 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.645 0.259 . . . . 0.0 110.693 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 34.6 mmt180 -64.39 119.18 9.87 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.004 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.455 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 0.8 OUTLIER -55.63 107.83 1.0 Allowed Pre-proline 0 CA--C 1.532 0.26 0 O-C-N 123.333 0.396 . . . . 0.0 111.513 -179.169 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -63.8 -21.18 69.41 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 122.697 2.265 . . . . 0.0 111.829 -175.634 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.624 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -69.48 -11.3 60.71 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.434 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.466 0.335 0 CA-C-O 121.159 0.504 . . . . 0.0 110.211 176.353 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.7 p30 . . . . . 0 C--O 1.232 0.173 0 CA-C-O 120.924 0.392 . . . . 0.0 110.082 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.554 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 39.1 t -91.07 108.1 25.81 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.183 174.813 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -72.68 -12.55 26.76 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.206 1.937 . . . . 0.0 111.189 176.343 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.554 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 14.3 mm -71.34 -15.18 18.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.988 -178.427 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.427 ' SG ' ' CG ' ' A' ' 22' ' ' GLU . 18.0 p -173.55 22.49 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 179.413 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 88.1 mt 58.73 24.66 12.49 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 176.46 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.427 ' CG ' ' SG ' ' A' ' 20' ' ' CYS . 42.9 mm-40 -99.15 159.92 14.64 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.668 0.271 . . . . 0.0 111.43 -177.376 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.25 148.27 52.08 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.206 177.3 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.486 HD13 ' O ' ' A' ' 39' ' ' LEU . 7.4 mt -138.44 120.8 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-O 121.087 0.47 . . . . 0.0 110.558 174.415 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 23.2 m80 -99.18 175.22 5.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.983 174.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 49.3 p -75.29 -39.65 59.46 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -173.229 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 35.5 t -45.32 117.85 1.53 Allowed 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.459 0.474 . . . . 0.0 112.202 -173.386 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.48 ' HA ' ' O ' ' A' ' 31' ' ' ALA . 0.0 OUTLIER -60.51 -20.83 61.43 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.053 179.463 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.2 t -57.55 -47.92 84.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-O 120.988 0.423 . . . . 0.0 110.397 179.479 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.525 ' O ' ' HA ' ' A' ' 41' ' ' HIS . 60.0 t -91.32 -50.59 12.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.324 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.544 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -99.79 102.78 14.31 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.06 -177.455 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.6 t60 -66.45 138.65 57.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.755 176.573 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 8.6 p -90.73 122.32 41.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-O 121.293 0.568 . . . . 0.0 111.254 -178.437 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.64 HD12 ' HB2' ' A' ' 38' ' ' HIS . 70.1 mt -72.28 154.56 92.0 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.615 174.324 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -58.03 -24.18 64.31 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 122.621 2.214 . . . . 0.0 112.201 177.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 48.0 t -89.72 9.03 28.71 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.575 -178.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.74 22.43 53.3 Favored Glycine 0 C--N 1.337 0.594 0 C-N-CA 121.415 -0.422 . . . . 0.0 113.665 173.004 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.64 ' HB2' HD12 ' A' ' 34' ' ' LEU . 71.4 m-70 -101.37 157.26 16.93 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 122.449 -0.442 . . . . 0.0 110.95 177.944 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.544 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 95.1 mt -112.56 137.38 50.87 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.982 174.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.529 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -154.28 142.83 20.73 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 174.205 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.525 ' HA ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -62.94 159.86 16.03 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.778 0.323 . . . . 0.0 111.576 -179.88 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.532 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 24.9 mmm180 -37.39 -67.64 0.18 Allowed 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 114.772 -1.104 . . . . 0.0 113.378 -174.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 89.4 m -60.95 -42.46 98.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.929 0.395 . . . . 0.0 111.154 -175.46 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.5 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -63.28 -25.73 68.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.078 -177.514 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.532 ' HB3' ' O ' ' A' ' 42' ' ' ARG . 44.3 t80 -60.13 -47.02 87.66 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 174.626 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -67.23 -42.73 83.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.183 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -54.93 -55.28 32.4 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.291 -178.091 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 15.5 ttp -68.64 -48.09 64.94 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.72 -175.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 39.2 tp -64.82 -28.95 69.91 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.858 -176.207 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -62.67 -43.31 99.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.263 0.554 . . . . 0.0 110.107 177.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -75.61 -38.45 59.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.713 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 67.32 28.4 73.67 Favored Glycine 0 CA--C 1.519 0.314 0 CA-C-N 115.857 -0.611 . . . . 0.0 112.776 178.176 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 17.1 p90 -85.11 176.89 8.12 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.42 ' O ' ' HD3' ' A' ' 56' ' ' PRO . 19.7 ptp180 -59.17 136.29 57.91 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 -179.331 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.5 p -72.62 107.15 2.73 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-O 120.615 0.245 . . . . 0.0 111.57 -177.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.42 ' HD3' ' O ' ' A' ' 54' ' ' ARG . 48.7 Cg_endo -67.45 -18.47 49.36 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.585 2.19 . . . . 0.0 111.927 -176.356 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.575 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -69.78 -15.67 63.16 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.553 -179.447 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.466 0.359 0 CA-C-O 120.984 0.421 . . . . 0.0 110.197 176.011 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.4 p30 . . . . . 0 C--O 1.234 0.258 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.433 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 40.7 t -96.76 107.64 38.11 Favored Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 110.224 -0.287 . . . . 0.0 110.224 177.475 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.15 -16.01 28.61 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.165 1.91 . . . . 0.0 111.447 178.676 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.433 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 17.2 mm -64.01 -27.2 42.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.746 -179.189 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.435 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 23.3 p -157.57 16.96 0.26 Allowed 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.345 -178.341 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 88.9 mt 55.89 29.26 13.84 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.053 0.541 . . . . 0.0 112.351 178.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.435 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 35.2 mm-40 -105.98 174.88 5.69 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.152 0.501 . . . . 0.0 111.933 -178.141 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -71.84 148.51 46.12 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.099 -0.955 . . . . 0.0 112.48 -174.095 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.405 HD11 ' HA ' ' A' ' 40' ' ' LEU . 6.2 mt -149.19 149.1 15.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 123.695 0.798 . . . . 0.0 109.04 174.938 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 45.1 m-70 -120.93 150.1 41.61 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 110.0 -0.371 . . . . 0.0 110.0 179.04 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.6 m -63.52 -17.4 62.75 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.25 -0.432 . . . . 0.0 112.078 -174.62 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.4 m -66.21 111.4 3.43 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.931 0.396 . . . . 0.0 110.932 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.473 ' HG2' HD21 ' A' ' 39' ' ' LEU . 64.8 mtm180 -72.82 -9.4 58.63 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.291 -176.496 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.9 p -71.32 -32.5 47.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.234 178.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.4 p -94.13 -36.35 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 CA-C-O 120.764 0.316 . . . . 0.0 111.227 -177.522 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -101.69 144.25 30.63 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.579 -178.773 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -72.31 131.77 43.13 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.082 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.405 ' HA ' HD23 ' A' ' 39' ' ' LEU . 7.3 p -93.46 124.55 45.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.065 0.459 . . . . 0.0 111.662 -175.794 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.706 HD12 ' HB2' ' A' ' 38' ' ' HIS . 55.0 mt -81.23 152.84 71.37 Favored Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.624 173.511 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -71.59 -2.59 11.58 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.734 2.289 . . . . 0.0 112.096 -178.255 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 46.6 t -104.04 9.27 36.54 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.068 176.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.3 23.14 49.24 Favored Glycine 0 C--N 1.336 0.563 0 CA-C-N 116.073 -0.512 . . . . 0.0 113.445 172.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.706 ' HB2' HD12 ' A' ' 34' ' ' LEU . 50.9 m-70 -104.19 156.01 18.25 Favored 'General case' 0 C--N 1.328 -0.335 0 O-C-N 122.538 -0.39 . . . . 0.0 111.239 177.763 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.473 HD21 ' HG2' ' A' ' 28' ' ' ARG . 60.7 mt -117.35 141.13 48.69 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.318 174.476 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.581 HD21 HD11 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -157.48 146.57 19.84 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.303 175.225 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.467 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -60.15 159.69 9.31 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.814 0.34 . . . . 0.0 111.071 179.794 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.447 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 21.7 mmt180 -47.37 -55.54 8.67 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.072 -0.967 . . . . 0.0 112.684 -168.528 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.41 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 60.5 m -65.71 -48.08 73.2 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 120.742 0.306 . . . . 0.0 111.149 -177.739 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.467 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -56.39 -28.2 58.53 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.164 -178.202 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.541 ' HB2' HD13 ' A' ' 40' ' ' LEU . 60.5 t80 -59.32 -53.04 62.76 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.263 0.554 . . . . 0.0 109.935 174.643 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -65.1 -36.47 84.42 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.673 -176.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 43' ' ' THR . 42.0 mt-10 -61.82 -54.92 35.58 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.816 -179.144 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 25.6 ttp -64.32 -44.76 90.53 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.962 0.41 . . . . 0.0 110.284 -178.237 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 55.9 tp -63.69 -34.79 78.63 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.829 -178.775 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.8 ttpp -60.49 -46.53 89.78 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.098 0.475 . . . . 0.0 109.99 177.617 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -66.79 -35.1 79.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.079 177.58 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 62.2 33.78 87.02 Favored Glycine 0 C--N 1.333 0.402 0 CA-C-N 115.626 -0.716 . . . . 0.0 112.866 176.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -96.75 176.1 6.12 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.631 0.216 . . . . 0.0 110.452 179.6 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.8 mtm180 -58.28 123.11 14.95 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.904 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.4 p -53.91 108.28 1.08 Allowed Pre-proline 0 CA--C 1.533 0.299 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.804 -179.601 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.06 -16.85 57.23 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 122.89 2.393 . . . . 0.0 112.859 -174.586 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.58 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.8 mp -70.45 -16.82 62.97 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 121.054 0.454 . . . . 0.0 110.315 178.898 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.466 0.341 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.226 173.321 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.3 p30 . . . . . 0 C--O 1.234 0.267 0 CA-C-O 120.801 0.334 . . . . 0.0 110.475 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.5 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 18.2 t -87.08 110.03 29.82 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.077 171.688 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -74.85 -18.45 19.12 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.508 2.139 . . . . 0.0 110.896 176.346 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.5 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 15.9 mm -61.7 -25.56 37.29 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.377 -175.204 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.467 ' SG ' ' HG3' ' A' ' 22' ' ' GLU . 18.3 p -164.81 18.22 0.05 Allowed 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.266 -177.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 80.6 mt 49.91 83.68 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.21 0.529 . . . . 0.0 111.642 -175.596 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.467 ' HG3' ' SG ' ' A' ' 20' ' ' CYS . 35.3 mt-10 -144.95 155.7 43.56 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.811 176.635 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -71.91 141.31 49.51 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 123.693 0.621 . . . . 0.0 110.512 175.704 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 10.0 mt -136.32 136.47 48.98 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.604 176.815 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -113.88 145.33 41.62 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.138 177.294 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.8 m -59.28 -15.91 18.52 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -173.725 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.8 m -45.47 108.52 0.13 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.288 0.566 . . . . 0.0 111.049 177.778 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -69.63 -30.01 67.63 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.532 -165.365 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 45.8 t -76.28 -19.71 15.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.888 0.375 . . . . 0.0 111.211 -174.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 94.3 t -99.8 -46.62 12.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.09 -179.564 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.35 113.37 23.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.197 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 46.0 t-80 -65.97 138.14 57.62 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.972 -178.404 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.3 p -93.8 131.53 40.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.271 0.558 . . . . 0.0 111.997 -176.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.676 HD12 ' HB2' ' A' ' 38' ' ' HIS . 60.4 mt -81.79 146.36 56.09 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.302 169.6 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -55.9 -20.85 30.98 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 122.591 2.194 . . . . 0.0 112.107 177.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.3 t -92.54 10.3 30.86 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.646 -177.386 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.59 17.91 59.4 Favored Glycine 0 C--N 1.337 0.61 0 N-CA-C 114.372 0.509 . . . . 0.0 114.372 170.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.676 ' HB2' HD12 ' A' ' 34' ' ' LEU . 47.3 m-70 -103.37 157.33 17.1 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 117.489 0.645 . . . . 0.0 110.671 177.673 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 91.6 mt -113.45 140.0 48.46 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.878 0.371 . . . . 0.0 110.881 177.126 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.512 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -152.33 159.18 43.5 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.733 176.476 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.459 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -71.95 168.83 17.17 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.65 0.262 . . . . 0.0 111.066 179.527 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 25.4 mmt180 -44.31 -62.26 1.23 Allowed 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.158 -0.928 . . . . 0.0 112.005 -174.269 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.6 m -64.77 -49.43 70.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.381 -175.071 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.459 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -56.47 -27.06 55.94 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.921 -0.581 . . . . 0.0 112.072 -176.003 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.512 ' HB2' HD13 ' A' ' 40' ' ' LEU . 42.4 t80 -58.18 -51.18 70.82 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.691 0.757 . . . . 0.0 109.64 173.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -71.81 -39.1 70.08 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.446 -1.252 . . . . 0.0 110.642 -176.293 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.48 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 42.5 mt-10 -57.7 -56.41 22.34 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.627 179.008 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 19.8 ttp -63.25 -45.11 93.07 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.127 -176.821 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 29.0 tp -66.45 -31.24 71.87 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.934 -176.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.3 ttpp -68.8 -48.27 64.04 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.121 178.327 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 6.2 mm-40 -64.76 -36.38 84.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.067 178.541 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.13 29.82 68.29 Favored Glycine 0 C--N 1.332 0.339 0 CA-C-N 115.604 -0.726 . . . . 0.0 113.626 173.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.431 ' CD1' ' HB2' ' A' ' 51' ' ' GLU . 39.0 p90 -89.18 169.81 11.14 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 117.045 0.423 . . . . 0.0 110.639 178.202 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 55.6 mtp180 -63.79 125.86 25.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.62 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -55.68 108.8 1.29 Allowed Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.838 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -65.61 -17.44 56.92 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 122.852 2.368 . . . . 0.0 112.389 -177.382 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.601 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -72.47 -8.43 55.03 Favored 'General case' 0 CA--C 1.528 0.112 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.545 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.466 0.363 0 CA-C-O 120.837 0.351 . . . . 0.0 110.563 177.76 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.406 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 33.4 p30 . . . . . 0 C--O 1.233 0.214 0 CA-C-O 121.522 0.677 . . . . 0.0 111.565 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 10.5 t -87.79 108.46 20.86 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.481 172.608 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.406 ' HD3' ' O ' ' A' ' 16' ' ' ASN . 22.4 Cg_exo -63.54 -28.89 70.39 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.407 2.071 . . . . 0.0 111.26 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 8.5 mm -57.14 -23.09 17.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.759 -173.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.4 p -158.08 14.76 0.21 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 120.702 0.287 . . . . 0.0 110.937 178.981 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 90.3 mt 45.9 67.55 0.73 Allowed 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.543 0.687 . . . . 0.0 111.618 -176.205 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -136.06 -177.92 4.91 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 114.986 -1.006 . . . . 0.0 109.971 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -77.54 151.93 34.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.882 0.372 . . . . 0.0 111.641 -177.275 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.474 HD11 ' HA ' ' A' ' 40' ' ' LEU . 2.9 mt -147.72 146.08 18.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.274 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.333 172.505 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.413 ' CG ' ' H ' ' A' ' 26' ' ' THR . 3.5 t-160 -127.69 -178.66 4.57 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.448 0.166 . . . . 0.0 110.762 -177.485 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.413 ' H ' ' CG ' ' A' ' 25' ' ' HIS . 6.3 m -72.61 -33.2 66.53 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -167.195 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.5 t -59.08 117.59 4.88 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 120.894 0.378 . . . . 0.0 112.002 -171.312 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.557 ' HG3' HD21 ' A' ' 39' ' ' LEU . 6.8 mpt_? -76.8 -6.9 54.18 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.897 176.511 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.5 t -87.17 -35.02 7.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.698 178.143 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.1 t -81.4 -55.26 8.39 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.883 176.447 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -94.66 125.38 39.27 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.697 177.649 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -67.89 133.03 48.44 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 -178.117 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.7 p -87.57 116.62 30.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-O 121.106 0.479 . . . . 0.0 111.008 179.228 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.567 HD12 ' HB2' ' A' ' 38' ' ' HIS . 73.3 mt -65.7 155.42 86.14 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.462 175.396 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.26 -14.76 25.73 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.791 2.327 . . . . 0.0 112.423 178.326 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 48.9 t -101.57 11.02 39.7 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.78 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 83.45 22.22 56.87 Favored Glycine 0 C--N 1.335 0.511 0 CA-C-N 116.224 -0.444 . . . . 0.0 114.153 171.697 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.626 ' HB3' HD22 ' A' ' 57' ' ' LEU . 48.7 m-70 -103.01 156.66 17.52 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 117.281 0.54 . . . . 0.0 110.909 177.406 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.557 HD21 ' HG3' ' A' ' 28' ' ' ARG . 80.4 mt -113.11 141.25 47.13 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.865 0.364 . . . . 0.0 110.79 177.774 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.545 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -157.85 150.15 22.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.949 175.263 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.49 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -64.64 165.33 10.42 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.703 0.287 . . . . 0.0 111.433 179.339 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.457 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 10.0 mmm180 -48.88 -66.26 0.43 Allowed 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.121 -0.945 . . . . 0.0 112.876 -171.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 48.1 m -58.06 -40.89 82.14 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.962 0.41 . . . . 0.0 110.842 -175.542 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.49 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.5 OUTLIER -65.94 -29.57 70.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.81 179.755 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.545 ' HB2' HD13 ' A' ' 40' ' ' LEU . 20.8 t80 -63.46 -55.6 22.88 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.394 178.194 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -59.24 -49.4 77.98 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.967 -175.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.428 ' HA ' ' HD3' ' A' ' 50' ' ' LYS . 7.3 mm-40 -57.19 -43.34 82.61 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.988 -178.995 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.436 ' SD ' ' C ' ' A' ' 48' ' ' MET . 0.7 OUTLIER -68.72 -44.48 73.79 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 121.069 0.462 . . . . 0.0 110.358 178.898 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.484 ' O ' HD13 ' A' ' 49' ' ' LEU . 2.3 tm? -66.2 -33.66 76.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.625 -174.962 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 46.6 mtpt -59.15 -34.36 71.99 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.968 178.663 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.421 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 42.6 mt-10 -96.15 -38.72 10.04 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.983 -177.438 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 65.12 26.95 71.77 Favored Glycine 0 CA--C 1.518 0.261 0 CA-C-N 115.99 -0.55 . . . . 0.0 112.375 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.421 ' HD1' ' HB2' ' A' ' 51' ' ' GLU . 33.7 p90 -70.71 177.92 3.32 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 122.425 0.29 . . . . 0.0 111.166 -177.5 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.427 ' O ' ' HD3' ' A' ' 56' ' ' PRO . 15.2 mmt180 -56.65 121.57 10.05 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.837 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.2 p -73.46 105.83 1.93 Allowed Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.413 -178.337 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.427 ' HD3' ' O ' ' A' ' 54' ' ' ARG . 46.4 Cg_endo -66.8 -13.79 41.28 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 122.58 2.187 . . . . 0.0 112.156 -176.655 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.626 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -73.54 -14.94 61.3 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.296 179.915 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.478 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.459 177.836 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 39.9 p30 . . . . . 0 N--CA 1.464 0.237 0 CA-C-O 121.163 0.506 . . . . 0.0 111.108 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.465 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 44.8 t -108.79 108.16 60.57 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.593 172.377 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -74.01 -14.97 23.59 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.264 1.976 . . . . 0.0 111.469 177.579 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.465 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 23.3 mm -64.44 -24.13 34.96 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.046 -177.82 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.0 p -161.16 10.81 0.09 Allowed 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 -177.594 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 9.3 mp 54.76 94.12 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.314 0.578 . . . . 0.0 110.569 -172.359 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -160.02 164.35 33.28 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.859 -178.069 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -73.83 137.55 43.87 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.734 -179.395 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.2 mt -141.12 148.33 21.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 174.867 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -134.98 166.0 24.04 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.0 m -52.06 -17.03 0.89 Allowed 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 122.994 0.518 . . . . 0.0 112.05 177.378 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.3 m -48.73 86.79 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.328 0.651 . . . . 0.0 111.882 179.192 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 50.2 ttp180 -81.1 -4.95 56.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.894 -176.505 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 47.9 t -80.27 -36.84 16.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.267 0.556 . . . . 0.0 109.741 175.42 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.2 t -88.65 -54.41 7.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.531 177.37 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.94 117.83 18.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.123 -179.753 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 48.4 t60 -69.52 127.56 33.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.036 -179.368 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.9 p -88.45 118.6 34.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.245 0.545 . . . . 0.0 111.284 -177.818 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.586 HD12 ' HB2' ' A' ' 38' ' ' HIS . 92.7 mt -62.81 150.4 87.4 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.755 172.845 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -59.05 -12.76 16.52 Favored 'Trans proline' 0 CA--C 1.535 0.537 0 C-N-CA 122.712 2.275 . . . . 0.0 112.953 177.691 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.3 t -96.91 6.69 48.18 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.77 0.319 . . . . 0.0 110.801 178.581 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.14 19.99 47.94 Favored Glycine 0 C--N 1.337 0.632 0 N-CA-C 114.286 0.474 . . . . 0.0 114.286 172.387 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.607 ' HB3' HD22 ' A' ' 57' ' ' LEU . 39.9 m-70 -104.0 156.87 17.51 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 117.505 0.652 . . . . 0.0 110.981 178.01 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.6 mt -113.65 137.07 52.12 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.79 0.328 . . . . 0.0 111.189 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.578 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -157.24 157.5 34.41 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.859 174.661 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.492 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -72.31 166.65 22.04 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.174 -179.693 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.495 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 26.3 mmm180 -49.13 -64.02 0.93 Allowed 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -172.746 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.489 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 27.2 m -60.56 -41.56 94.82 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.572 0.225 . . . . 0.0 110.628 -175.432 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.492 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -62.34 -27.57 69.15 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 120.884 0.373 . . . . 0.0 110.479 178.535 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.578 ' HB2' HD13 ' A' ' 40' ' ' LEU . 25.0 t80 -70.74 -44.76 66.13 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.933 174.816 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.41 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 42.7 mt-10 -66.9 -27.9 67.87 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.677 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.489 ' HG3' ' O ' ' A' ' 43' ' ' THR . 43.9 mt-10 -73.21 -51.79 16.46 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.24 175.136 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.446 ' SD ' ' C ' ' A' ' 48' ' ' MET . 0.6 OUTLIER -62.32 -54.27 42.94 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.894 -176.776 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 65.6 tp -61.72 -28.44 69.42 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.095 -177.603 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.534 ' HB2' ' NZ ' ' A' ' 50' ' ' LYS . 4.6 ttmp? -61.49 -40.63 95.29 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.057 0.456 . . . . 0.0 110.579 178.475 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.423 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 19.8 mm-40 -88.25 -33.12 18.19 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.011 -178.775 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 61.64 29.95 73.41 Favored Glycine 0 C--N 1.334 0.466 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.307 -178.829 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.493 ' HB2' ' NH1' ' A' ' 54' ' ' ARG . 16.0 p90 -82.52 174.04 11.43 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 120.806 0.336 . . . . 0.0 111.154 -175.351 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.493 ' NH1' ' HB2' ' A' ' 53' ' ' TYR . 0.3 OUTLIER -57.44 138.79 54.62 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.747 177.939 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.403 ' HA ' ' HD2' ' A' ' 56' ' ' PRO . 0.9 OUTLIER -90.37 107.17 18.08 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -175.353 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 55' ' ' CYS . 33.5 Cg_endo -63.63 -15.0 46.07 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.781 2.321 . . . . 0.0 112.192 179.461 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.607 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.9 mp -75.38 -6.64 51.01 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.418 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.466 0.337 0 CA-C-O 121.014 0.435 . . . . 0.0 109.869 173.172 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.401 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 8.4 p30 . . . . . 0 N--CA 1.457 -0.121 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.51 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 22.1 t -82.92 108.78 13.54 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.365 177.324 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.41 ' HG3' ' HG ' ' A' ' 57' ' ' LEU . 73.3 Cg_endo -74.89 -7.42 19.23 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.269 1.979 . . . . 0.0 111.437 179.492 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.51 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 21.3 mm -72.3 -22.98 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.41 178.793 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.679 ' SG ' ' HG3' ' A' ' 22' ' ' GLU . 21.3 p -163.09 22.62 0.09 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 120.726 0.298 . . . . 0.0 111.574 -179.528 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.406 HD12 ' N ' ' A' ' 21' ' ' LEU . 7.1 mp 57.32 25.93 11.79 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 174.479 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.679 ' HG3' ' SG ' ' A' ' 20' ' ' CYS . 54.0 mt-10 -93.28 -179.42 5.06 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 120.712 0.291 . . . . 0.0 110.62 178.257 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -90.39 149.53 22.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.406 177.84 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.4 mt -137.08 137.19 46.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 175.497 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 18.3 t60 -111.82 156.47 21.93 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 -177.733 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.5 t -56.7 -16.96 7.3 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -177.754 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.0 t -61.65 93.88 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.137 0.494 . . . . 0.0 110.839 -178.86 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 50.0 ttp180 -76.61 -14.32 60.0 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.625 -178.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.8 p -68.57 -19.03 23.87 Favored 'Isoleucine or valine' 0 C--O 1.238 0.447 0 CA-C-O 121.473 0.654 . . . . 0.0 109.495 173.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 61.2 t -99.09 -63.14 1.72 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.533 173.032 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.77 123.05 21.77 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.21 -178.017 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -76.17 140.31 41.67 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.804 178.653 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.404 ' HA ' ' O ' ' A' ' 38' ' ' HIS . 7.5 p -98.05 120.13 46.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-O 121.183 0.516 . . . . 0.0 111.308 -179.421 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.628 HD12 ' HB2' ' A' ' 38' ' ' HIS . 84.6 mt -61.27 148.65 84.88 Favored Pre-proline 0 C--O 1.233 0.215 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.022 172.742 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -56.8 -19.68 32.27 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.595 2.197 . . . . 0.0 112.45 179.008 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 46.7 t -88.98 0.35 56.73 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.975 -178.387 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.35 19.33 28.24 Favored Glycine 0 C--N 1.335 0.502 0 C-N-CA 121.41 -0.424 . . . . 0.0 114.084 174.225 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.628 ' HB2' HD12 ' A' ' 34' ' ' LEU . 54.6 m-70 -103.32 156.62 17.6 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 117.424 0.612 . . . . 0.0 111.241 179.412 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.0 mt -112.98 139.8 48.33 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 120.848 0.356 . . . . 0.0 111.445 178.513 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.563 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -162.86 149.04 12.37 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.579 176.178 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.563 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -58.9 158.43 8.33 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.042 175.547 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.528 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 9.9 mmt85 -50.91 -58.24 6.5 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 115.729 -0.668 . . . . 0.0 112.241 -170.316 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.444 ' O ' ' HG2' ' A' ' 47' ' ' GLU . 26.6 m -55.84 -44.25 77.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.238 -177.716 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.563 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -62.44 -31.9 72.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.764 179.267 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.563 ' HB2' HD13 ' A' ' 40' ' ' LEU . 34.5 t80 -62.34 -47.67 83.19 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.845 175.554 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -62.35 -51.47 67.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.56 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 43' ' ' THR . 23.0 mm-40 -62.84 -37.18 85.78 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.583 -177.779 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.453 ' SD ' ' C ' ' A' ' 48' ' ' MET . 0.5 OUTLIER -67.89 -51.36 48.93 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.255 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.4 tp -66.64 -28.42 68.46 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.589 -179.661 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -57.5 -50.62 72.47 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.371 177.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.418 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 28.5 mm-40 -79.92 -32.73 40.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.46 178.807 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 61.8 32.86 83.29 Favored Glycine 0 C--N 1.331 0.276 0 CA-C-N 115.91 -0.587 . . . . 0.0 112.46 179.155 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.418 ' HD1' ' HB2' ' A' ' 51' ' ' GLU . 22.8 p90 -77.66 -175.93 4.1 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.858 0.361 . . . . 0.0 110.727 -179.365 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.528 ' H ' ' HD2' ' A' ' 54' ' ' ARG . 2.4 mpt_? -72.73 122.37 21.39 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -177.944 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.4 p -61.8 107.3 1.07 Allowed Pre-proline 0 C--N 1.329 -0.323 0 O-C-N 123.102 0.251 . . . . 0.0 111.273 -178.336 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -59.84 -28.9 88.26 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.748 2.299 . . . . 0.0 112.163 -173.34 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.574 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.6 mp -62.61 -16.81 58.42 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.952 0.406 . . . . 0.0 110.85 -177.161 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.466 0.328 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.617 176.608 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.579 ' N ' HD21 ' A' ' 16' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.836 0.35 . . . . 0.0 110.354 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.458 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 43.5 t -92.27 108.19 28.95 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.704 176.613 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.433 ' HG2' ' HG2' ' A' ' 56' ' ' PRO . 73.6 Cg_endo -76.52 -8.67 18.43 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.246 1.964 . . . . 0.0 111.617 177.135 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.458 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 20.6 mm -70.91 -23.12 23.43 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.943 -177.58 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.471 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 21.4 p -162.18 12.63 0.08 Allowed 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -177.391 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 7.5 mp 54.97 91.02 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.215 0.531 . . . . 0.0 109.92 -171.609 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.471 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 0.4 OUTLIER -155.37 167.48 30.24 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.361 -174.134 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -88.92 143.32 26.95 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.708 0.29 . . . . 0.0 110.401 179.272 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.4 mt -142.48 142.24 27.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.365 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -123.74 177.6 5.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.276 179.128 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 15.2 t -75.81 -15.82 60.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.593 -173.861 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.5 m -57.52 89.91 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 120.927 0.394 . . . . 0.0 111.224 179.396 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.505 ' HG2' HD21 ' A' ' 39' ' ' LEU . 82.8 mtt85 -71.81 -11.48 60.83 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.055 -177.78 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 66.6 t -66.74 -35.31 74.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.232 0.539 . . . . 0.0 109.994 173.796 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 40.0 t -94.08 -53.69 8.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.951 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -84.54 116.8 23.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.061 178.555 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -65.38 124.82 23.26 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.273 -177.856 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.492 ' HA ' HD23 ' A' ' 39' ' ' LEU . 7.3 p -80.73 116.94 25.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.099 0.476 . . . . 0.0 110.95 178.768 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.621 HD12 ' HB2' ' A' ' 38' ' ' HIS . 76.2 mt -65.98 154.91 88.42 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.046 174.149 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -67.99 -5.55 14.91 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.323 2.015 . . . . 0.0 111.475 178.197 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 30.2 t -106.03 14.49 27.76 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.402 178.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.66 2.53 75.69 Favored Glycine 0 C--N 1.341 0.846 0 N-CA-C 114.948 0.739 . . . . 0.0 114.948 169.764 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.621 ' HB2' HD12 ' A' ' 34' ' ' LEU . 25.9 m-70 -96.95 156.83 16.18 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 117.525 0.662 . . . . 0.0 111.339 -175.813 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.505 HD21 ' HG2' ' A' ' 28' ' ' ARG . 98.1 mt -114.0 142.57 46.0 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.876 178.616 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.528 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -157.04 152.12 26.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.862 175.872 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.15 167.82 9.48 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.991 178.761 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.509 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 15.4 mmm180 -50.17 -60.45 2.95 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.174 -169.233 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 28.3 m -66.22 -41.43 90.09 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.247 -175.609 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.8 -26.38 67.25 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 120.77 0.319 . . . . 0.0 110.694 -178.941 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.528 ' HB2' HD13 ' A' ' 40' ' ' LEU . 39.5 t80 -59.67 -48.84 80.1 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.008 174.566 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -65.82 -44.31 85.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.629 -179.73 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -57.8 -51.69 68.52 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.925 -178.003 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 9.5 tmm? -65.0 -49.39 70.43 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.19 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 54.1 tp -62.12 -31.1 71.53 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.103 -177.266 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.4 ttmm -63.58 -40.44 96.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.918 0.389 . . . . 0.0 110.272 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -75.62 -41.4 54.41 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.363 176.342 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.87 45.92 94.32 Favored Glycine 0 C--N 1.333 0.388 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 -176.092 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -102.91 -175.71 2.89 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.784 0.325 . . . . 0.0 110.513 -175.453 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.454 ' HG3' ' O ' ' A' ' 54' ' ' ARG . 34.8 ptt180 -56.78 110.6 0.83 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.296 177.707 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.422 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 0.8 OUTLIER -64.81 105.48 0.74 Allowed Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.731 -0.213 . . . . 0.0 110.646 178.936 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.433 ' HG2' ' HG2' ' A' ' 18' ' ' PRO . 22.3 Cg_endo -59.49 -22.51 66.66 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 122.806 2.337 . . . . 0.0 112.408 -172.493 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.561 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.3 mp -66.93 -20.55 65.92 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.518 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.7 OUTLIER . . . . . 0 N--CA 1.466 0.372 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.096 174.606 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.464 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 12.9 m120 . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.904 0.383 . . . . 0.0 111.078 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.457 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 44.1 t -80.4 109.41 12.66 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.497 175.251 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.528 ' HG2' ' HG2' ' A' ' 56' ' ' PRO . 92.5 Cg_endo -80.86 -4.92 12.96 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.454 2.103 . . . . 0.0 111.665 177.22 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.457 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 19.0 mm -72.96 -20.29 18.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.705 -178.843 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.717 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 21.2 p -163.61 17.69 0.07 Allowed 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.243 -179.283 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.452 HD12 ' N ' ' A' ' 21' ' ' LEU . 6.4 mp 49.08 80.0 0.07 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.164 0.506 . . . . 0.0 109.969 -174.052 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.717 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 0.5 OUTLIER -150.24 170.67 18.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.66 -173.078 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -82.93 137.49 34.19 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 122.889 0.475 . . . . 0.0 111.406 -177.823 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 26.6 mt -136.72 131.32 47.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 109.641 -0.504 . . . . 0.0 109.641 171.469 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 66.7 m170 -117.37 178.73 4.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.588 178.866 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.9 t -65.46 -17.31 64.45 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -174.026 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 67.7 m -60.12 94.52 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.055 0.455 . . . . 0.0 111.562 -178.802 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.6 mtt85 -80.45 17.29 1.11 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.667 -178.427 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.6 t -88.94 -51.8 11.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.122 0.487 . . . . 0.0 109.705 173.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 57.6 t -84.32 -38.18 13.49 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.977 177.789 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.451 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -82.19 97.65 8.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.801 175.98 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.402 ' O ' HD12 ' A' ' 40' ' ' LEU . 9.3 t60 -61.11 136.48 58.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.912 -178.547 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.7 p -89.76 124.69 42.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.213 0.53 . . . . 0.0 111.222 -177.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.657 HD12 ' HB2' ' A' ' 38' ' ' HIS . 60.5 mt -76.27 151.85 83.65 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.408 174.515 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.5 -22.5 35.01 Favored 'Trans proline' 0 CA--C 1.535 0.531 0 C-N-CA 122.58 2.186 . . . . 0.0 112.295 175.118 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.2 t -95.46 12.8 28.1 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.853 -177.348 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 83.8 15.6 70.01 Favored Glycine 0 C--N 1.337 0.627 0 N-CA-C 114.5 0.56 . . . . 0.0 114.5 170.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.657 ' HB2' HD12 ' A' ' 34' ' ' LEU . 59.3 m-70 -100.01 156.62 17.06 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 117.555 0.678 . . . . 0.0 110.619 178.044 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.451 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 97.1 mt -112.66 142.5 45.19 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.674 176.959 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.537 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -159.27 140.79 13.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.784 175.006 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.513 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -54.18 155.42 3.68 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.648 0.261 . . . . 0.0 111.413 179.115 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.512 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 55.1 mmm-85 -36.35 -66.57 0.21 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.26 1.024 . . . . 0.0 113.284 -173.265 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 30.8 m -64.53 -36.58 84.65 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.762 0.315 . . . . 0.0 111.486 -172.893 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.513 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -64.14 -28.54 69.83 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.736 -178.942 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.537 ' HB2' HD13 ' A' ' 40' ' ' LEU . 32.3 t80 -58.49 -50.03 75.22 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.818 175.299 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -66.63 -41.61 88.04 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.232 -178.611 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.417 ' O ' ' HB3' ' A' ' 50' ' ' LYS . 19.2 mm-40 -56.58 -54.99 39.58 Favored 'General case' 0 C--O 1.235 0.335 0 O-C-N 123.332 0.395 . . . . 0.0 111.724 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 14.7 ttp -61.67 -49.67 75.57 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.141 0.496 . . . . 0.0 110.338 -178.024 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 32.0 tp -64.7 -28.61 69.72 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.539 -178.177 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.417 ' HB3' ' O ' ' A' ' 47' ' ' GLU . 34.7 ttpt -63.61 -47.85 79.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.405 177.357 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.402 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 51.4 mt-10 -75.4 -26.95 58.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.75 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 62.9 25.97 68.38 Favored Glycine 0 C--N 1.331 0.304 0 CA-C-N 115.956 -0.565 . . . . 0.0 113.27 175.791 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.402 ' HD1' ' HB2' ' A' ' 51' ' ' GLU . 20.0 p90 -83.71 176.12 9.19 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 178.588 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 32.3 mtp180 -70.3 130.6 42.42 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 -176.314 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 1.5 p -60.37 107.4 1.03 Allowed Pre-proline 0 CA--C 1.532 0.258 0 CA-C-O 120.663 0.268 . . . . 0.0 111.553 -178.542 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.528 ' HG2' ' HG2' ' A' ' 18' ' ' PRO . 39.5 Cg_endo -66.19 -18.21 55.7 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.757 2.304 . . . . 0.0 112.32 -175.399 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.589 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -69.88 -13.25 62.16 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 120.937 0.399 . . . . 0.0 110.182 179.247 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.465 0.314 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.319 173.262 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.586 ' N ' HD21 ' A' ' 16' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.132 0 CA-C-O 121.159 0.504 . . . . 0.0 110.624 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.413 ' HB2' HG13 ' A' ' 24' ' ' ILE . 33.4 t -72.6 110.07 7.41 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.759 177.869 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.571 ' HG2' ' HG ' ' A' ' 57' ' ' LEU . 15.6 Cg_exo -67.62 -19.94 47.51 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.464 2.109 . . . . 0.0 111.373 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.453 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 10.4 mm -70.04 -18.39 21.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.387 -174.514 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.57 ' SG ' ' HG3' ' A' ' 22' ' ' GLU . 19.1 p -167.87 21.95 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 121.047 -0.261 . . . . 0.0 111.689 -178.331 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 89.3 mt 55.98 28.69 13.07 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.57 ' HG3' ' SG ' ' A' ' 20' ' ' CYS . 39.0 mt-10 -91.54 -177.73 4.89 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 177.072 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -91.94 151.56 20.46 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.889 0.376 . . . . 0.0 110.475 175.692 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.413 HG13 ' HB2' ' A' ' 17' ' ' CYS . 15.2 mt -143.05 111.98 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 173.06 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 35.4 t60 -89.88 150.91 22.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.178 -177.403 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 12.9 m -53.36 -25.46 15.38 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.085 -177.254 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.8 p -64.74 89.47 0.07 Allowed 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.09 0.471 . . . . 0.0 110.367 177.3 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.2 ppt_? -78.22 18.96 0.47 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.997 -175.408 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.8 p -73.05 -30.95 33.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-O 121.206 0.527 . . . . 0.0 109.687 172.195 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.0 p -101.62 -38.55 6.01 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.436 177.339 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -82.6 111.11 18.28 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.51 179.726 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -64.82 133.52 52.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.117 -179.719 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.3 p -92.1 122.14 43.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.082 0.468 . . . . 0.0 111.131 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.594 HD12 ' HB2' ' A' ' 38' ' ' HIS . 82.7 mt -67.81 155.08 92.42 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.639 172.119 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.41 -12.82 35.02 Favored 'Trans proline' 0 CA--C 1.531 0.357 0 C-N-CA 122.102 1.868 . . . . 0.0 111.736 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 38.4 t -100.74 13.69 34.07 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.593 -179.613 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.19 17.34 65.03 Favored Glycine 0 C--N 1.336 0.578 0 N-CA-C 114.458 0.543 . . . . 0.0 114.458 169.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.604 ' HB3' HD22 ' A' ' 57' ' ' LEU . 41.9 m-70 -103.27 156.11 17.96 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 117.53 0.665 . . . . 0.0 110.421 177.426 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.5 mt -112.01 144.6 41.09 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.849 0.357 . . . . 0.0 111.252 -179.418 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.543 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -163.31 151.47 13.62 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.301 175.551 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.554 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -69.83 163.28 26.2 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.886 178.165 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.481 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 57.3 mmm-85 -48.53 -57.67 5.81 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 123.822 0.701 . . . . 0.0 112.183 -174.576 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 42.8 p -52.73 -57.04 11.4 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.423 0.63 . . . . 0.0 110.599 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.554 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.5 OUTLIER -58.15 -26.67 62.99 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.111 -0.95 . . . . 0.0 111.679 -179.971 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.543 ' HB2' HD13 ' A' ' 40' ' ' LEU . 39.6 t80 -66.71 -48.98 67.51 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 177.427 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -63.98 -43.57 95.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.455 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -57.2 -53.05 62.46 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.138 178.811 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.431 ' SD ' ' C ' ' A' ' 48' ' ' MET . 1.0 OUTLIER -65.61 -50.87 63.47 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.618 -177.063 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 42.8 tp -62.85 -30.28 71.38 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.715 -177.512 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 45.8 tttm -62.1 -51.48 67.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.127 0.489 . . . . 0.0 110.214 175.964 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.438 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 11.0 mm-40 -67.25 -35.44 79.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.641 -177.102 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 63.34 24.48 67.51 Favored Glycine 0 CA--C 1.519 0.32 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.937 176.809 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.438 ' HD1' ' HB2' ' A' ' 51' ' ' GLU . 14.8 p90 -79.77 163.4 24.49 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.58 ' H ' ' HD3' ' A' ' 54' ' ' ARG . 0.8 OUTLIER -61.07 130.33 45.8 Favored 'General case' 0 C--N 1.332 -0.152 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 -179.496 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.2 p -64.65 114.06 13.11 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.148 -174.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -67.96 -24.8 39.1 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.735 2.29 . . . . 0.0 111.879 -178.558 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.604 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -65.25 -15.79 62.86 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.62 -178.313 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.467 0.388 0 CA-C-O 120.871 0.367 . . . . 0.0 110.676 175.022 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.58 ' N ' HD21 ' A' ' 16' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.209 0 CA-C-O 121.204 0.526 . . . . 0.0 110.396 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.533 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 18.8 t -78.31 111.05 15.94 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.267 179.558 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -72.87 -12.98 26.55 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.214 1.943 . . . . 0.0 111.677 177.658 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.533 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 24.4 mm -71.35 -19.23 20.66 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.155 -178.07 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.6 p -168.31 20.5 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 120.962 -0.295 . . . . 0.0 111.775 -179.348 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.447 HD12 ' N ' ' A' ' 21' ' ' LEU . 6.3 mp 48.26 72.72 0.25 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.009 0.433 . . . . 0.0 110.716 -177.555 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -146.64 -176.62 5.26 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.379 -173.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -78.12 139.29 39.02 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.086 -176.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.457 HD13 ' O ' ' A' ' 39' ' ' LEU . 11.9 mt -145.43 140.31 22.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.288 169.901 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 22.8 m80 -145.46 173.47 11.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.635 0.255 . . . . 0.0 110.605 176.09 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 63.2 m -60.0 -24.64 64.62 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.802 -0.636 . . . . 0.0 112.691 -173.305 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -55.4 98.69 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.186 0.517 . . . . 0.0 110.853 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.49 -25.19 66.58 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.714 -174.693 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.471 HG13 HG23 ' A' ' 30' ' ' VAL . 13.6 p -58.27 -31.27 42.01 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-O 121.084 0.469 . . . . 0.0 110.162 179.231 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.471 HG23 HG13 ' A' ' 29' ' ' VAL . 73.0 t -96.61 -49.47 12.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.008 177.218 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.575 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -94.59 103.79 15.74 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.088 -177.929 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -66.56 139.37 57.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.855 178.887 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 52.4 t -87.19 120.85 37.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-O 120.735 0.302 . . . . 0.0 111.279 -178.383 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.583 HD12 ' HB2' ' A' ' 38' ' ' HIS . 55.2 mt -73.45 152.82 89.92 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.331 172.749 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -64.11 1.15 1.69 Allowed 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 123.241 2.627 . . . . 0.0 113.583 -178.51 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 47.7 t -115.7 4.26 14.03 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.781 0.325 . . . . 0.0 110.818 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.48 24.23 26.72 Favored Glycine 0 C--N 1.335 0.505 0 C-N-CA 121.219 -0.515 . . . . 0.0 113.987 173.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.583 ' HB2' HD12 ' A' ' 34' ' ' LEU . 69.1 m-70 -103.48 155.52 18.45 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 117.115 0.457 . . . . 0.0 110.669 174.994 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.575 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 88.8 mt -113.01 142.68 45.43 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.451 177.333 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.544 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -158.04 140.4 14.39 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.759 174.362 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.564 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -55.55 156.2 4.87 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.865 0.364 . . . . 0.0 111.096 -179.653 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.567 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 8.6 mmm180 -43.75 -59.81 2.07 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 114.857 -1.065 . . . . 0.0 113.098 -168.588 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 18.5 m -67.24 -37.65 83.9 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.605 0.241 . . . . 0.0 111.442 -174.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.564 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -62.19 -27.41 68.95 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.904 0.383 . . . . 0.0 110.289 179.243 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.567 ' HB3' ' O ' ' A' ' 42' ' ' ARG . 41.8 t80 -60.85 -47.45 86.32 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.103 175.681 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -60.85 -45.87 92.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.409 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.472 ' HA ' ' HE2' ' A' ' 50' ' ' LYS . 11.7 mm-40 -63.6 -40.02 95.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.849 -177.142 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.429 ' C ' ' SD ' ' A' ' 48' ' ' MET . 8.5 tmm? -72.64 -51.2 20.55 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.147 0.498 . . . . 0.0 109.708 179.826 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.8 tp -60.29 -27.69 67.49 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.617 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.472 ' HE2' ' HA ' ' A' ' 47' ' ' GLU . 17.3 ttmm -49.64 -38.73 33.49 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.226 177.018 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.8 mm-40 -93.73 -38.76 11.13 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.942 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 63.02 20.73 62.86 Favored Glycine 0 C--N 1.333 0.391 0 C-N-CA 121.14 -0.552 . . . . 0.0 112.418 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -71.14 -173.7 0.88 Allowed 'General case' 0 C--O 1.237 0.419 0 CA-C-O 120.88 0.371 . . . . 0.0 111.576 -178.567 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.49 136.32 58.01 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 175.442 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.447 ' HA ' ' HD2' ' A' ' 56' ' ' PRO . 0.8 OUTLIER -80.99 108.53 10.45 Favored Pre-proline 0 C--N 1.323 -0.562 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -172.253 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.447 ' HD2' ' HA ' ' A' ' 55' ' ' CYS . 27.5 Cg_endo -61.45 -20.95 70.52 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.468 2.112 . . . . 0.0 112.084 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.547 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -70.86 -12.08 61.33 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.724 -178.332 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.469 0.498 0 CA-C-O 121.234 0.54 . . . . 0.0 110.264 176.241 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.462 ' N ' HD21 ' A' ' 16' ' ' ASN . 0.1 OUTLIER . . . . . 0 C--O 1.234 0.275 0 CA-C-O 121.305 0.574 . . . . 0.0 110.482 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 17.4 t -90.8 109.69 36.44 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.225 176.102 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.51 ' HG2' ' HG ' ' A' ' 57' ' ' LEU . 20.6 Cg_exo -64.75 -25.72 60.83 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.387 2.058 . . . . 0.0 111.775 179.772 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.551 HD11 HD11 ' A' ' 57' ' ' LEU . 10.3 mm -62.81 -28.03 44.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 115.179 -0.919 . . . . 0.0 111.591 -173.565 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.1 p -155.59 12.1 0.33 Allowed 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 111.588 0.218 . . . . 0.0 111.588 -178.719 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 76.1 mt 52.37 79.56 0.11 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 122.838 0.455 . . . . 0.0 111.65 -177.289 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -144.32 167.6 22.06 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.227 -177.7 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -73.95 132.07 42.07 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.783 -177.078 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.9 mt -137.64 126.18 33.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 C-N-CA 122.927 0.491 . . . . 0.0 109.774 174.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 66.2 m170 -116.29 -172.46 2.18 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.941 0.401 . . . . 0.0 111.231 -178.188 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.9 t -61.24 -17.66 54.44 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.676 -176.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.3 t -59.8 99.51 0.07 Allowed 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.994 0.426 . . . . 0.0 111.101 -177.316 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.41 ' C ' ' HD2' ' A' ' 28' ' ' ARG . 0.7 OUTLIER -88.81 -1.92 58.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.435 178.2 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.3 p -89.95 -38.44 11.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.391 179.141 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 93.8 t -75.28 -54.94 12.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 175.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -86.85 137.37 32.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.161 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.9 t60 -73.96 134.1 43.09 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -179.579 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 9.0 p -96.14 121.89 47.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-O 121.267 0.556 . . . . 0.0 111.113 -178.051 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.602 HD12 ' HB2' ' A' ' 38' ' ' HIS . 86.1 mt -70.58 155.87 92.76 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.445 175.841 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -65.3 -15.73 51.32 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 122.341 2.027 . . . . 0.0 111.813 178.864 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 46.5 t -93.63 8.42 40.92 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.334 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 83.32 23.66 53.72 Favored Glycine 0 C--N 1.336 0.548 0 CA-C-N 116.006 -0.543 . . . . 0.0 114.056 172.376 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.677 ' HB3' HD22 ' A' ' 57' ' ' LEU . 44.9 m-70 -103.81 155.57 18.5 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 117.303 0.551 . . . . 0.0 110.271 175.805 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 61.3 mt -113.49 138.22 50.43 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.443 176.203 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.527 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -156.75 149.29 23.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.82 175.648 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.425 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -68.58 168.92 12.0 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.06 179.73 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.474 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 8.3 mmt180 -53.05 -60.73 2.92 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.651 -168.564 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 28.8 m -61.73 -43.8 98.16 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.992 0.425 . . . . 0.0 110.856 -178.063 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.425 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.5 OUTLIER -61.84 -26.47 68.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.2 -178.374 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.527 ' HB2' HD13 ' A' ' 40' ' ' LEU . 48.3 t80 -62.17 -49.51 75.55 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.214 0.53 . . . . 0.0 109.578 173.34 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -59.64 -46.56 88.62 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.188 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -56.63 -56.16 24.86 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.882 -175.833 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 15.4 ttp -64.96 -47.03 79.08 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.256 0.55 . . . . 0.0 110.47 -175.76 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 61.6 tp -66.42 -28.84 68.93 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.834 -177.029 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -65.21 -46.41 80.81 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.961 0.41 . . . . 0.0 110.586 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.474 ' HB2' ' CD1' ' A' ' 53' ' ' TYR . 14.1 mm-40 -65.52 -23.81 66.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.802 -177.897 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 63.18 43.13 99.07 Favored Glycine 0 C--N 1.331 0.27 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.832 176.029 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.474 ' CD1' ' HB2' ' A' ' 51' ' ' GLU . 3.3 p90 -118.16 161.34 20.02 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.505 ' CD ' ' H ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -55.75 137.48 49.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.269 0.557 . . . . 0.0 111.107 179.803 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -63.39 115.67 19.85 Favored Pre-proline 0 CA--C 1.535 0.387 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.671 -171.495 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -66.46 -12.4 35.57 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 122.895 2.397 . . . . 0.0 112.356 -179.431 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.677 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.4 mp -79.28 -8.23 58.9 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 110.295 -0.261 . . . . 0.0 110.295 178.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.468 0.446 0 CA-C-O 120.894 0.378 . . . . 0.0 110.247 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 . . . . . 0 N--CA 1.479 0.98 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -74.48 84.67 2.01 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.033 0.444 . . . . 0.0 110.375 -177.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 34.1 m -94.35 -15.15 7.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.728 179.233 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 70.0 m -69.32 -16.69 63.6 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.028 178.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -108.29 118.44 36.78 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 176.32 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.2 mm-40 -76.99 162.45 27.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.86 -169.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 39.6 p30 -139.61 162.69 34.49 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.649 178.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.451 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 26.2 t -93.18 108.48 33.23 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.375 175.615 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -72.94 -16.95 25.64 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.246 1.964 . . . . 0.0 111.422 177.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.476 HD11 HD11 ' A' ' 57' ' ' LEU . 16.8 mm -63.18 -23.31 32.96 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.972 -177.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.464 ' SG ' ' HG3' ' A' ' 22' ' ' GLU . 21.7 p -161.69 18.15 0.1 Allowed 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -179.023 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 89.1 mt 59.36 35.22 23.09 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 176.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.464 ' HG3' ' SG ' ' A' ' 20' ' ' CYS . 38.6 mt-10 -103.94 -175.89 2.93 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 175.683 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -80.52 162.62 24.25 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.643 178.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.588 HD11 ' HA ' ' A' ' 40' ' ' LEU . 0.3 OUTLIER -160.77 153.49 4.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 122.909 0.483 . . . . 0.0 110.008 176.435 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.401 ' CD2' ' HB3' ' A' ' 27' ' ' SER . 9.0 p-80 -146.42 164.16 33.35 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.31 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.3 p -64.91 -24.18 67.45 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 -171.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.416 ' OG ' HG12 ' A' ' 29' ' ' VAL . 32.9 t -59.17 112.82 1.85 Allowed 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.037 0.446 . . . . 0.0 110.668 179.25 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.734 ' HD3' ' H ' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -100.38 16.61 23.9 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.542 -174.63 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.573 HG13 HG23 ' A' ' 30' ' ' VAL . 7.2 p -76.18 -35.59 28.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.155 0.502 . . . . 0.0 109.677 173.511 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.573 HG23 HG13 ' A' ' 29' ' ' VAL . 57.4 t -97.19 -46.88 12.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.072 176.674 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.11 123.22 26.61 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.437 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -73.67 138.69 44.9 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 21.7 t -89.15 119.89 36.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.793 -178.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.569 HD12 ' HB2' ' A' ' 38' ' ' HIS . 76.6 mt -68.91 152.16 96.92 Favored Pre-proline 0 C--N 1.328 -0.338 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 169.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -66.61 -8.85 22.29 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.286 1.99 . . . . 0.0 112.238 -177.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 42.7 t -100.11 9.97 42.0 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.327 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.52 8.84 63.66 Favored Glycine 0 C--N 1.338 0.679 0 N-CA-C 114.663 0.625 . . . . 0.0 114.663 169.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.582 ' HB3' HD22 ' A' ' 57' ' ' LEU . 62.7 m-70 -94.81 156.89 16.17 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 117.553 0.677 . . . . 0.0 111.079 -178.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.4 mt -113.28 143.06 45.06 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.18 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.588 ' HA ' HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -158.29 142.27 15.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.682 174.986 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.608 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -55.77 154.62 6.78 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.573 0.225 . . . . 0.0 110.602 175.693 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.447 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 15.5 mmt180 -47.8 -54.92 10.9 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.535 -170.395 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.43 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 92.5 m -56.27 -41.09 75.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.069 0.461 . . . . 0.0 111.121 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.608 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -70.5 -25.48 63.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.966 -177.588 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.512 ' HB2' HD13 ' A' ' 40' ' ' LEU . 45.5 t80 -62.2 -42.65 99.49 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 173.757 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.457 ' O ' ' HG3' ' A' ' 50' ' ' LYS . 36.7 mt-10 -65.56 -49.23 69.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.584 176.233 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.489 ' HA ' ' HD3' ' A' ' 50' ' ' LYS . 42.4 mt-10 -54.66 -48.19 72.64 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.334 -178.562 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.476 ' C ' ' SD ' ' A' ' 48' ' ' MET . 0.5 OUTLIER -68.33 -51.9 39.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.493 -177.658 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 53.3 tp -61.83 -28.52 69.54 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.923 -176.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.489 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 9.6 mtpm? -53.68 -50.07 66.62 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.152 0.501 . . . . 0.0 110.42 173.355 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.442 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 7.4 mm-40 -76.14 -44.46 38.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.031 -176.147 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 69.75 22.78 76.95 Favored Glycine 0 C--N 1.333 0.364 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.641 -176.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.442 ' HD1' ' HB2' ' A' ' 51' ' ' GLU . 5.7 p90 -75.67 170.81 15.45 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 122.732 0.413 . . . . 0.0 111.2 -175.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -60.72 124.68 21.14 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.932 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.6 p -65.22 110.13 3.87 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -176.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.582 ' O ' ' HG2' ' A' ' 59' ' ' MET . 48.6 Cg_endo -67.52 -26.33 40.39 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.636 2.224 . . . . 0.0 112.088 -176.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.582 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -61.63 -17.63 56.1 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 120.871 0.367 . . . . 0.0 110.72 -177.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -62.97 -12.32 24.82 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.214 178.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.582 ' HG2' ' O ' ' A' ' 56' ' ' PRO . 26.8 ptm -89.99 -16.41 29.9 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.608 0.242 . . . . 0.0 111.329 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -125.51 127.61 46.7 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 -175.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.2 p . . . . . 0 C--O 1.25 1.117 0 CA-C-O 118.936 -0.554 . . . . 0.0 109.928 -179.297 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 . . . . . 0 N--CA 1.479 0.984 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 22.9 m120 60.53 91.76 0.05 Allowed 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.172 0.51 . . . . 0.0 110.843 -177.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 26.9 m -113.66 34.19 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.035 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.2 m -68.47 83.53 0.27 Allowed 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.609 -174.151 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 49.1 tp60 -165.86 93.83 0.56 Allowed 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 175.03 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -76.93 165.74 24.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.254 -173.296 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -127.77 139.21 52.81 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 176.159 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.46 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 27.2 t -72.48 109.34 5.76 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.606 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.65 -15.46 21.66 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.297 1.998 . . . . 0.0 111.353 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.46 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 26.7 mm -63.24 -23.47 33.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.204 -177.453 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 29.5 p -157.1 12.12 0.23 Allowed 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -179.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 88.2 mt 53.72 69.53 0.7 Allowed 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.326 0.584 . . . . 0.0 110.759 -175.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -146.09 146.06 30.77 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.188 -0.914 . . . . 0.0 108.856 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -67.58 162.57 23.16 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -176.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.7 tt -145.76 146.77 19.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.843 0.354 . . . . 0.0 110.583 -176.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -93.45 144.66 25.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.044 178.468 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 15.4 t -75.59 -18.32 59.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.889 0.376 . . . . 0.0 110.522 178.267 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.413 ' O ' HG12 ' A' ' 30' ' ' VAL . 9.0 t -63.5 117.67 7.07 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.092 178.292 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 67.6 ttt-85 -63.7 -31.27 72.39 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.508 -176.316 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.409 HG12 ' OG ' ' A' ' 27' ' ' SER . 12.4 p -60.83 -22.75 27.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -174.596 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.413 HG12 ' O ' ' A' ' 27' ' ' SER . 7.0 p -106.79 2.53 10.1 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-O 120.888 0.375 . . . . 0.0 111.702 -174.669 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -138.02 164.84 28.07 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.993 0.425 . . . . 0.0 111.068 -177.294 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 42.4 t-80 -100.41 135.61 41.57 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 174.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 48.8 t -95.21 122.33 46.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.609 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.664 HD12 ' HB2' ' A' ' 38' ' ' HIS . 71.1 mt -72.09 153.2 92.68 Favored Pre-proline 0 C--N 1.325 -0.495 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 173.534 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -63.49 -17.31 59.45 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.577 2.184 . . . . 0.0 111.746 -178.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.4 t -93.5 7.96 42.55 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.504 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.51 23.7 46.06 Favored Glycine 0 C--N 1.337 0.634 0 CA-C-N 116.257 -0.429 . . . . 0.0 113.668 172.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.664 ' HB2' HD12 ' A' ' 34' ' ' LEU . 43.5 m-70 -103.5 156.99 17.35 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 122.595 -0.356 . . . . 0.0 111.175 178.085 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 44.4 mt -111.11 142.94 42.62 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.879 177.343 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.493 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -160.63 145.3 14.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.821 173.089 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.559 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -58.88 162.27 4.26 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.68 0.276 . . . . 0.0 110.687 176.478 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.491 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 24.4 mmt180 -50.4 -57.12 8.71 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.811 -169.044 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 24.8 p -59.44 -49.04 79.35 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.39 -177.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.559 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -59.22 -27.95 66.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.56 -176.456 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.493 ' HB2' HD13 ' A' ' 40' ' ' LEU . 31.5 t80 -55.3 -53.64 53.63 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.611 0.72 . . . . 0.0 109.783 174.435 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.493 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 6.4 mm-40 -69.66 -37.66 76.81 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.542 -1.208 . . . . 0.0 110.57 -177.902 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -62.56 -41.16 98.74 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.53 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 19.5 ttp -75.19 -50.39 16.38 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.026 0.441 . . . . 0.0 110.155 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 48.8 tp -61.55 -28.71 69.53 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.425 -177.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.493 ' HB2' ' O ' ' A' ' 46' ' ' GLU . 22.7 ttmm -57.96 -45.18 87.08 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.076 176.421 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.9 mm-40 -74.4 -40.81 61.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.158 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 65.19 46.22 88.45 Favored Glycine 0 N--CA 1.451 -0.317 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.374 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 20.8 p90 -104.49 -179.51 3.97 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -64.14 120.17 11.58 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.882 -177.252 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.6 p -54.59 108.24 1.09 Allowed Pre-proline 0 C--O 1.235 0.315 0 CA-C-O 120.77 0.319 . . . . 0.0 111.845 -178.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.47 ' O ' ' HG2' ' A' ' 59' ' ' MET . 40.6 Cg_endo -65.16 -19.19 62.78 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 122.784 2.323 . . . . 0.0 112.422 -174.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.585 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -71.59 -11.27 60.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.989 0.423 . . . . 0.0 110.323 -179.343 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -75.37 -22.96 57.11 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.901 173.087 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.47 ' HG2' ' O ' ' A' ' 56' ' ' PRO . 27.3 ptt? -108.77 -22.42 12.23 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.674 0.273 . . . . 0.0 111.061 -178.051 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.492 ' O ' ' HA ' ' A' ' 57' ' ' LEU . 3.9 m80 -142.66 121.99 13.1 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 178.457 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 29.2 t . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.813 -0.613 . . . . 0.0 109.776 -175.234 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 . . . . . 0 N--CA 1.482 1.143 0 CA-C-O 120.853 0.358 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -53.54 113.91 1.34 Allowed 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.383 -174.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 60.2 t -62.58 110.36 0.72 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.259 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.686 177.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 17.4 m -93.09 66.71 4.15 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.625 -176.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.481 ' OE1' ' HA ' ' A' ' 25' ' ' HIS . 8.3 tp-100 -161.21 149.25 15.58 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.619 178.048 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -88.21 167.1 13.87 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 120.954 0.407 . . . . 0.0 110.863 -175.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -143.57 161.61 38.03 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.269 179.501 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.57 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 42.8 t -97.74 111.06 57.89 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.641 -177.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.424 ' HG2' ' HG ' ' A' ' 57' ' ' LEU . 72.0 Cg_endo -77.5 -12.34 16.94 Favored 'Trans proline' 0 CA--C 1.534 0.504 0 C-N-CA 122.259 1.973 . . . . 0.0 112.129 175.111 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.57 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 29.0 mm -59.85 -44.47 94.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-O 120.794 0.331 . . . . 0.0 110.808 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.562 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 27.8 p -132.0 15.72 4.7 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.539 -177.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 51.8 mt 52.41 72.28 0.41 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 121.28 0.562 . . . . 0.0 109.591 -175.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.562 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 21.1 tt0 -146.13 -176.45 5.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.311 -171.458 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.496 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 16.0 t70 -86.82 156.35 19.92 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 122.543 0.337 . . . . 0.0 111.308 178.725 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.559 HG13 ' HB2' ' A' ' 17' ' ' CYS . 8.5 mt -148.87 105.1 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 169.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.481 ' HA ' ' OE1' ' A' ' 14' ' ' GLN . 1.8 p80 -76.1 136.65 39.85 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.535 -0.542 . . . . 0.0 109.535 172.788 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.7 m -52.81 -17.69 1.5 Allowed 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -171.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.6 m -52.35 106.42 0.15 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 120.857 0.36 . . . . 0.0 111.338 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -62.61 -24.39 67.56 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.111 -178.286 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.7 t -53.54 -30.67 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-O 121.079 0.466 . . . . 0.0 110.955 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 60.6 t -106.26 -47.09 8.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.452 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.57 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -79.55 107.0 11.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.703 -178.107 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.597 ' HB2' HH11 ' A' ' 42' ' ' ARG . 9.4 t60 -69.1 134.99 50.08 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.211 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.2 t -87.15 115.2 27.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.249 -178.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.651 HD12 ' HB2' ' A' ' 38' ' ' HIS . 43.0 mt -72.01 147.82 91.37 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.99 170.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -55.61 -24.64 46.18 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.818 2.345 . . . . 0.0 112.498 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.9 t -88.72 5.92 41.06 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.761 -177.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.24 23.66 33.9 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 121.315 -0.469 . . . . 0.0 113.54 173.299 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.651 ' HB2' HD12 ' A' ' 34' ' ' LEU . 70.3 m-70 -102.89 155.61 18.23 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.9 0.35 . . . . 0.0 111.013 178.026 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.57 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 81.1 mt -115.71 136.93 52.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.343 175.778 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.584 HD21 HD11 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -160.26 146.36 15.44 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.747 0.308 . . . . 0.0 111.101 175.222 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.549 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -58.91 157.65 9.51 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.223 178.39 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.597 HH11 ' HB2' ' A' ' 32' ' ' HIS . 26.2 mmt180 -46.57 -58.37 3.87 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.567 -171.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.445 ' O ' ' HG2' ' A' ' 47' ' ' GLU . 28.4 m -57.65 -48.26 79.98 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.003 0.43 . . . . 0.0 110.93 -177.499 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.549 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -61.01 -28.74 69.26 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.921 -179.214 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.559 ' HB2' HD13 ' A' ' 40' ' ' LEU . 39.6 t80 -65.16 -55.29 19.49 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.501 177.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -61.5 -48.22 82.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.265 -175.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 43' ' ' THR . 48.6 mm-40 -59.69 -45.48 91.95 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -175.804 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 18.9 ttp -65.87 -44.99 83.73 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.029 0.442 . . . . 0.0 110.053 -179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 42.8 tp -68.89 -28.15 66.43 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.766 -179.135 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.443 ' HE2' ' HB3' ' A' ' 50' ' ' LYS . 4.7 tmmm? -68.45 -33.85 74.92 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.049 179.352 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -76.98 -56.23 4.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.593 173.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 91.0 14.68 57.44 Favored Glycine 0 C--N 1.332 0.314 0 CA-C-N 115.842 -0.617 . . . . 0.0 113.334 175.561 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 21.9 p90 -75.38 173.55 10.77 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 117.007 0.404 . . . . 0.0 110.333 177.554 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 -56.7 128.03 34.42 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.551 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.2 p -54.26 109.62 1.64 Allowed Pre-proline 0 C--O 1.235 0.306 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.546 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.459 ' HG2' HD13 ' A' ' 19' ' ' ILE . 23.9 Cg_endo -60.78 -25.93 82.06 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.729 2.286 . . . . 0.0 112.658 -175.301 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.571 HD22 ' HB3' ' A' ' 38' ' ' HIS . 3.9 mp -65.46 -15.68 62.88 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 120.902 0.382 . . . . 0.0 110.967 -177.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -73.93 -32.71 63.64 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.581 176.755 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 83.1 mmm -109.43 -18.36 13.56 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 120.938 0.399 . . . . 0.0 111.365 -175.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.41 ' O ' ' HA ' ' A' ' 57' ' ' LEU . 75.9 m80 -134.09 134.79 42.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.56 -175.111 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 9.9 p . . . . . 0 C--O 1.251 1.146 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.546 176.84 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 . . . . . 0 N--CA 1.479 0.999 0 CA-C-O 120.876 0.369 . . . . 0.0 110.135 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -112.14 40.21 2.24 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.094 0.473 . . . . 0.0 110.833 -177.177 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 13.8 p -77.24 -30.55 17.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.898 -178.604 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.0 m -81.4 -17.15 49.94 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.774 -178.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -79.98 122.94 27.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.35 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -62.95 124.83 22.09 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.009 177.05 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 34.8 p30 -148.44 162.09 40.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.021 0.439 . . . . 0.0 110.391 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.605 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 35.5 t -99.11 109.29 53.72 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.333 -177.309 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -74.24 -16.56 22.21 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.451 2.101 . . . . 0.0 111.557 175.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.605 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 34.4 mm -61.03 -25.89 37.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.022 -179.048 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 27.6 p -156.7 18.4 0.32 Allowed 'General case' 0 N--CA 1.466 0.349 0 O-C-N 122.41 -0.181 . . . . 0.0 111.335 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 80.2 mt 56.27 39.88 30.07 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.916 0.388 . . . . 0.0 111.507 177.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -118.29 174.33 6.29 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.183 -178.243 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -67.69 153.51 43.54 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.357 -175.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.514 HD11 ' HA ' ' A' ' 40' ' ' LEU . 1.8 mt -153.87 146.16 14.19 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 CA-C-N 115.287 -0.87 . . . . 0.0 108.986 171.435 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 24.0 m80 -149.25 -170.14 3.55 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 122.328 0.251 . . . . 0.0 110.564 178.47 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.487 ' O ' ' HD2' ' A' ' 28' ' ' ARG . 51.7 p -62.99 -17.55 62.26 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -173.338 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.5 m -57.54 99.45 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 111.536 0.199 . . . . 0.0 111.536 -178.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.52 ' H ' ' HD2' ' A' ' 28' ' ' ARG . 5.2 mpt_? -71.57 -28.73 64.04 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.191 0.52 . . . . 0.0 110.134 178.62 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 46.7 t -62.67 -38.14 80.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.079 177.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.538 ' O ' ' HA ' ' A' ' 41' ' ' HIS . 60.9 t -82.32 -62.62 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.85 -0.613 . . . . 0.0 109.658 176.398 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.527 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -85.69 98.72 10.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.491 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -61.98 143.45 56.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.34 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 40.2 t -86.89 115.58 27.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.363 -177.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.643 HD12 ' HB2' ' A' ' 38' ' ' HIS . 32.2 mt -67.39 151.79 96.81 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.812 173.422 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -59.15 -19.02 47.29 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.87 2.38 . . . . 0.0 111.896 174.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 32.5 t -99.51 18.17 18.55 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.501 -178.646 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.91 15.19 79.62 Favored Glycine 0 C--N 1.338 0.666 0 N-CA-C 114.706 0.642 . . . . 0.0 114.706 169.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.645 ' HB3' HD22 ' A' ' 57' ' ' LEU . 36.3 m-70 -103.0 157.39 17.01 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 117.58 0.69 . . . . 0.0 111.041 178.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.527 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 97.6 mt -108.57 138.54 44.71 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.849 177.439 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.537 HD21 HD11 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -158.91 138.9 12.04 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 122.83 0.452 . . . . 0.0 110.482 174.125 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.538 ' HA ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -56.46 163.5 1.72 Allowed 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.674 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.407 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 18.6 mmt180 -43.15 -64.72 0.58 Allowed 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 114.884 -1.053 . . . . 0.0 112.551 -173.815 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 24.3 p -56.56 -47.47 79.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.114 0.483 . . . . 0.0 110.923 -177.01 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.489 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.5 OUTLIER -61.98 -28.75 69.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.232 -179.671 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.522 ' HB2' HD13 ' A' ' 40' ' ' LEU . 53.5 t80 -68.63 -53.14 24.42 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.047 0.451 . . . . 0.0 110.034 176.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -62.28 -45.07 94.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.741 -177.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.1 mm-40 -59.85 -54.52 45.28 Favored 'General case' 0 C--O 1.234 0.261 0 O-C-N 123.129 0.268 . . . . 0.0 111.609 178.67 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.471 ' HA ' ' CE1' ' A' ' 53' ' ' TYR . 6.8 ttp -58.94 -40.79 85.72 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.131 0.491 . . . . 0.0 110.175 -176.776 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.1 tp -75.85 -29.91 58.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.875 -178.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 50.1 tttm -65.51 -51.11 62.34 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.257 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -71.24 -31.45 67.56 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.932 174.056 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 62.38 38.59 96.52 Favored Glycine 0 N--CA 1.452 -0.28 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.458 177.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.471 ' CE1' ' HA ' ' A' ' 48' ' ' MET . 41.1 p90 -88.12 -175.95 5.24 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.786 0.327 . . . . 0.0 110.634 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.847 ' H ' ' HD2' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -75.22 144.77 42.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.355 -173.951 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.5 p -84.27 107.09 9.69 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.805 -178.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -67.23 -13.52 39.82 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 122.516 2.144 . . . . 0.0 111.811 179.085 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.645 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -74.99 -6.75 51.02 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.44 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -73.5 -24.8 60.22 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 173.722 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.445 ' C ' ' SD ' ' A' ' 59' ' ' MET . 0.8 OUTLIER -87.33 -47.79 8.52 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.522 174.212 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 76.7 t60 -105.07 102.73 12.21 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.009 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 70.7 m . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.907 -0.568 . . . . 0.0 109.807 176.055 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 . . . . . 0 N--CA 1.481 1.093 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -101.95 116.72 33.32 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.8 t -102.4 -47.85 10.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.958 0.408 . . . . 0.0 110.679 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.1 t -88.91 5.16 45.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.366 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -136.09 146.18 46.74 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -88.65 153.79 20.83 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 121.055 0.455 . . . . 0.0 110.351 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -124.07 150.24 45.21 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.981 175.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.526 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 10.6 t -90.38 108.99 30.54 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.805 -176.749 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -68.96 -11.37 31.66 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.256 1.971 . . . . 0.0 112.041 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.526 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 26.5 mm -71.87 -21.1 20.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.875 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.417 ' SG ' ' CG ' ' A' ' 22' ' ' GLU . 21.8 p -164.12 17.49 0.06 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 120.944 -0.303 . . . . 0.0 111.776 -179.483 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.419 ' N ' ' O ' ' A' ' 17' ' ' CYS . 60.1 mt 53.67 31.08 12.06 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.417 ' CG ' ' SG ' ' A' ' 20' ' ' CYS . 56.4 mm-40 -101.97 -177.59 3.46 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.23 178.639 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -74.75 148.4 40.47 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -174.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.512 HD11 ' HA ' ' A' ' 40' ' ' LEU . 4.5 mt -149.72 124.0 1.68 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 C-N-CA 123.38 0.672 . . . . 0.0 109.924 170.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 18.1 t-80 -108.5 157.82 18.1 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 177.145 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.3 p -54.06 -22.48 10.87 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 9.6 m -61.94 100.51 0.16 Allowed 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.018 0.437 . . . . 0.0 110.555 177.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.9 ppt_? -81.18 16.81 1.43 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.532 -176.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 56.4 t -71.21 -47.63 59.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 172.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.419 ' O ' ' HA ' ' A' ' 41' ' ' HIS . 7.8 p -86.1 -38.4 12.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.199 175.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.511 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -86.76 101.86 13.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.67 -179.023 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -59.52 137.14 58.11 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.362 178.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 30.6 t -86.25 108.81 18.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.593 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.677 HD12 ' HB2' ' A' ' 38' ' ' HIS . 43.2 mt -66.9 151.04 97.4 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.286 173.519 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.4 -24.59 69.42 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.726 2.284 . . . . 0.0 112.237 179.495 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 43.0 t -91.13 7.73 39.15 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.65 -177.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.98 22.54 45.11 Favored Glycine 0 C--N 1.337 0.588 0 CA-C-N 116.103 -0.499 . . . . 0.0 113.872 172.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.677 ' HB2' HD12 ' A' ' 34' ' ' LEU . 78.0 m-70 -101.64 155.94 17.8 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 117.263 0.531 . . . . 0.0 110.784 177.07 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.511 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 71.0 mt -115.75 136.38 53.11 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.558 177.066 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.593 HD21 HD11 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -161.19 140.31 10.19 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.005 175.368 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.583 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -53.65 153.09 4.62 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.604 0.24 . . . . 0.0 111.518 179.354 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.477 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 15.3 mmt180 -44.24 -57.04 3.69 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.941 0.897 . . . . 0.0 112.203 -172.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.456 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 61.1 m -52.7 -49.35 65.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.04 -178.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.583 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -65.1 -30.87 71.85 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.029 -177.914 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.509 ' HB2' HD13 ' A' ' 40' ' ' LEU . 13.3 t80 -60.88 -50.31 73.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.98 175.817 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.471 ' O ' ' HG3' ' A' ' 50' ' ' LYS . 47.6 mt-10 -64.87 -41.43 95.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.592 -179.239 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 43' ' ' THR . 43.8 mt-10 -55.65 -55.36 33.05 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.998 0.428 . . . . 0.0 110.835 177.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 15.6 ttp -65.49 -40.92 93.63 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.918 -175.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 34.9 tp -73.84 -28.76 61.76 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.552 -173.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.471 ' HG3' ' O ' ' A' ' 46' ' ' GLU . 56.5 mttp -57.26 -47.73 80.68 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.104 0.478 . . . . 0.0 110.049 175.504 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -70.27 -39.18 75.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.61 173.188 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 64.63 19.76 65.3 Favored Glycine 0 N--CA 1.45 -0.416 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.257 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.2 p90 -70.75 173.94 6.62 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 120.761 0.315 . . . . 0.0 110.651 -177.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 67.9 mtt180 -65.04 122.9 18.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.532 -175.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.423 ' HA ' ' HD2' ' A' ' 56' ' ' PRO . 1.4 p -54.12 112.46 3.88 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.772 -173.486 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' ' 55' ' ' CYS . 34.3 Cg_endo -63.73 -24.86 68.68 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.73 2.287 . . . . 0.0 112.332 -178.624 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.57 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.6 mp -66.65 -14.42 62.44 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 120.762 0.315 . . . . 0.0 110.823 -178.158 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -75.36 -28.82 59.69 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.976 174.113 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 23.8 ptp -109.78 -14.02 14.38 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 -175.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 41.7 m80 -147.02 166.56 26.45 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 122.512 0.325 . . . . 0.0 110.149 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 40.9 m . . . . . 0 C--O 1.253 1.242 0 CA-C-O 119.011 -0.519 . . . . 0.0 109.647 178.813 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 . . . . . 0 N--CA 1.482 1.128 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -161.35 145.88 13.38 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.101 -178.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 27.6 m -65.51 -27.36 41.48 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.199 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.3 p -108.01 156.23 19.46 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.307 177.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.466 ' NE2' HG23 ' A' ' 26' ' ' THR . 28.7 tt0 -66.08 -57.07 8.53 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.8 mp0 -123.89 141.15 52.29 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 168.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -101.43 135.88 42.2 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.226 0.536 . . . . 0.0 110.568 -177.618 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.556 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 11.1 t -82.37 108.45 11.86 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.63 177.193 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.85 -11.52 29.53 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.171 1.914 . . . . 0.0 111.539 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.556 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 21.0 mm -69.5 -25.81 29.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.684 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.803 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 17.4 p -165.21 22.77 0.05 Allowed 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -177.025 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 90.9 mt 59.03 24.71 12.99 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 176.593 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.803 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 0.3 OUTLIER -97.33 171.21 8.56 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 -177.515 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -76.34 150.75 36.84 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.977 0.417 . . . . 0.0 111.239 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.467 HD13 ' O ' ' A' ' 39' ' ' LEU . 7.4 mt -144.12 121.9 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.261 172.77 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 -105.05 159.71 15.61 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.933 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.541 ' O ' ' HD3' ' A' ' 28' ' ' ARG . 0.9 OUTLIER -59.33 -17.5 29.99 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -177.714 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.3 m -59.63 104.89 0.31 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.631 -0.259 . . . . 0.0 111.687 -177.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.541 ' HD3' ' O ' ' A' ' 26' ' ' THR . 1.7 mpp_? -66.88 -14.61 62.93 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.776 0.322 . . . . 0.0 110.683 176.855 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 58.4 t -69.99 -33.22 54.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.554 176.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 59.2 t -98.24 -50.58 11.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.275 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.516 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -93.09 113.29 25.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.254 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -62.16 128.29 35.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.739 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.413 ' HA ' HD23 ' A' ' 39' ' ' LEU . 7.2 p -83.66 121.52 36.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.269 0.557 . . . . 0.0 111.337 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.62 HD12 ' HB2' ' A' ' 38' ' ' HIS . 94.9 mt -73.05 154.34 90.72 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.647 174.692 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -62.64 -9.99 17.96 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.779 2.319 . . . . 0.0 112.251 178.193 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.8 t -107.23 17.46 22.88 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.207 0.527 . . . . 0.0 109.847 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.56 -14.89 63.75 Favored Glycine 0 C--N 1.341 0.84 0 N-CA-C 114.966 0.746 . . . . 0.0 114.966 168.184 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.62 ' HB2' HD12 ' A' ' 34' ' ' LEU . 14.2 m-70 -81.78 156.7 24.8 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 117.572 0.686 . . . . 0.0 111.385 -173.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.516 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 97.5 mt -109.65 145.27 36.77 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.282 177.004 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.513 HD21 HD11 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -157.96 152.43 24.73 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 174.047 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.45 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -70.59 171.81 9.64 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.76 0.314 . . . . 0.0 111.379 -179.577 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.476 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 12.3 mmm180 -46.48 -67.25 0.3 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.775 -173.621 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 22.3 m -60.71 -43.86 97.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.06 0.457 . . . . 0.0 110.681 -175.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.45 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.6 OUTLIER -63.68 -23.94 67.58 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.586 -176.27 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.512 ' HB2' HD13 ' A' ' 40' ' ' LEU . 34.4 t80 -61.4 -50.3 73.42 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 173.61 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.412 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 49.0 mt-10 -67.67 -41.21 84.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.721 -179.126 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -56.62 -51.03 70.23 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.489 -177.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 13.6 ttp -70.18 -49.52 49.55 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.933 0.397 . . . . 0.0 110.656 -177.462 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.4 tp -62.2 -34.77 77.1 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.913 -176.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 46' ' ' GLU . 38.6 ttmt -55.06 -48.04 74.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.286 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -68.9 -43.9 74.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.208 177.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.78 18.89 79.42 Favored Glycine 0 CA--C 1.519 0.287 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.861 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.439 ' CE2' ' HD3' ' A' ' 56' ' ' PRO . 13.7 p90 -79.06 176.9 9.23 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 178.243 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 79.2 mtp180 -62.41 119.47 9.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.613 0.244 . . . . 0.0 110.353 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.487 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 0.5 OUTLIER -51.37 113.87 4.41 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.51 178.426 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.439 ' HD3' ' CE2' ' A' ' 53' ' ' TYR . 35.0 Cg_endo -63.78 -17.59 60.51 Favored 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 122.519 2.146 . . . . 0.0 111.534 -178.508 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.496 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.8 mp -75.92 -2.66 31.35 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.143 179.074 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.5 OUTLIER -74.2 -16.1 60.99 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 171.461 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 62.7 mtm -105.8 -4.9 20.3 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.225 175.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -144.0 95.86 2.8 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.054 179.097 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 32.3 t . . . . . 0 C--O 1.25 1.122 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.128 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.417 ' OE1' HG22 ' A' ' 12' ' ' VAL . 0.3 OUTLIER . . . . . 0 N--CA 1.484 1.273 0 CA-C-O 120.797 0.332 . . . . 0.0 111.016 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -160.16 66.7 0.35 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.437 0.637 . . . . 0.0 109.309 174.367 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.417 HG22 ' OE1' ' A' ' 10' ' ' GLU . 25.7 m -85.42 71.69 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.623 0.725 . . . . 0.0 111.304 -178.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.1 t -82.24 86.39 6.67 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 175.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -136.51 113.04 10.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.382 -175.212 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.634 ' O ' ' HB ' ' A' ' 24' ' ' ILE . 85.3 mm-40 -90.87 81.87 5.7 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 176.589 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.522 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 32.6 m-80 -60.99 139.45 58.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.723 -174.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.572 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 12.8 t -71.2 110.23 6.93 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.518 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.522 ' HD3' ' O ' ' A' ' 16' ' ' ASN . 5.0 Cg_exo -75.06 -13.44 21.28 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.547 2.164 . . . . 0.0 110.864 174.352 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.572 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 11.9 mm -66.0 -27.0 39.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.856 -176.522 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.444 ' SG ' ' OE2' ' A' ' 22' ' ' GLU . 18.3 p -165.15 20.41 0.05 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 111.672 0.249 . . . . 0.0 111.672 -178.664 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 90.8 mt 55.73 89.65 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.81 0.338 . . . . 0.0 111.186 -177.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.444 ' OE2' ' SG ' ' A' ' 20' ' ' CYS . 26.6 mt-10 -157.09 171.86 19.7 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.651 -179.571 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -83.3 145.62 28.99 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.996 175.341 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.634 ' HB ' ' O ' ' A' ' 15' ' ' GLN . 34.2 mt -138.75 111.73 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.34 173.58 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -80.35 150.92 29.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.683 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 16.3 p -57.74 -17.87 17.96 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -177.379 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.4 m -66.3 97.21 0.39 Allowed 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.735 0.302 . . . . 0.0 110.934 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.652 ' HD3' ' H ' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -78.09 11.41 2.31 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.101 0.477 . . . . 0.0 111.344 -179.046 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 37.4 t -74.39 -45.36 46.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 172.442 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.6 p -87.58 -44.81 16.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.052 178.064 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.85 112.89 18.65 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.233 -0.439 . . . . 0.0 109.946 177.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.403 ' O ' HD12 ' A' ' 40' ' ' LEU . 19.2 t60 -61.08 131.02 49.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.298 -178.78 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.43 ' HA ' HD23 ' A' ' 39' ' ' LEU . 7.3 p -86.36 120.61 36.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.017 179.226 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.6 HD12 ' HB2' ' A' ' 38' ' ' HIS . 76.2 mt -74.86 153.37 86.96 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.074 173.26 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.5 -18.13 58.91 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.295 1.996 . . . . 0.0 111.674 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 37.0 t -90.76 9.03 31.67 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.328 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.18 19.21 57.79 Favored Glycine 0 C--N 1.338 0.666 0 CA-C-N 116.112 -0.495 . . . . 0.0 114.127 171.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.6 ' HB2' HD12 ' A' ' 34' ' ' LEU . 61.2 m-70 -104.18 157.15 17.32 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 117.4 0.6 . . . . 0.0 111.1 177.686 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' A' ' 33' ' ' VAL . 93.5 mt -113.52 143.93 43.7 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.358 175.32 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.558 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -159.18 148.02 18.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.477 175.615 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.561 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.1 OUTLIER -58.25 151.76 18.71 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.446 175.858 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.472 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 17.5 mmt85 -47.84 -57.44 5.64 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.842 0.714 . . . . 0.0 112.092 -170.108 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.441 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 20.2 m -53.63 -40.43 65.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.171 0.51 . . . . 0.0 111.387 -178.289 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.561 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -72.14 -25.35 61.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.999 -176.058 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.558 ' HB2' HD13 ' A' ' 40' ' ' LEU . 20.5 t80 -61.2 -46.64 89.62 Favored 'General case' 0 C--O 1.232 0.143 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 173.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.73 -51.0 71.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.288 176.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 43' ' ' THR . 42.4 mt-10 -54.65 -55.87 25.03 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.615 -177.085 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 10.1 ttp -63.35 -44.95 93.38 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.777 -175.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 64.9 tp -64.09 -34.02 77.09 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.649 -177.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.424 ' HB3' ' NZ ' ' A' ' 50' ' ' LYS . 8.8 mtpm? -67.86 -50.23 57.65 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.972 0.415 . . . . 0.0 110.658 176.554 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -63.61 -29.35 70.61 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.85 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 60.93 23.71 61.79 Favored Glycine 0 C--N 1.332 0.319 0 CA-C-N 115.829 -0.623 . . . . 0.0 113.328 174.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -85.8 169.21 13.58 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 110.333 -0.247 . . . . 0.0 110.333 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 38.0 mmt180 -58.1 127.22 30.99 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.709 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 1.2 p -60.79 106.33 0.76 Allowed Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.214 178.285 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -65.93 -18.08 56.75 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.714 2.276 . . . . 0.0 112.272 -174.196 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.573 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.7 mp -68.76 -17.3 64.02 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.153 178.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.7 OUTLIER -66.18 -17.37 64.68 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.991 0.425 . . . . 0.0 110.422 174.23 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 27.3 ttt -89.18 -11.17 44.52 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.401 177.215 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 -128.11 99.23 5.39 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.781 -178.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.8 p . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.787 -0.625 . . . . 0.0 109.679 175.7 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.481 1.124 0 CA-C-O 121.222 0.534 . . . . 0.0 111.387 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 -157.14 129.46 7.37 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.057 168.298 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.7 t -73.41 109.77 6.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.982 -175.412 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.1 p -81.17 -33.17 33.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.577 177.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -66.16 104.92 1.26 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.638 178.145 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.477 ' HB3' HG22 ' A' ' 24' ' ' ILE . 6.4 tp-100 -77.25 145.97 37.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.112 -173.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -106.65 142.62 36.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.112 0.482 . . . . 0.0 109.865 174.558 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.453 ' HB2' HG13 ' A' ' 24' ' ' ILE . 33.3 t -85.98 111.09 35.67 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.793 -178.203 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.506 ' HG2' ' HG ' ' A' ' 57' ' ' LEU . 17.2 Cg_exo -64.91 -19.01 63.9 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.353 2.036 . . . . 0.0 111.398 179.268 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.473 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 11.7 mm -76.65 -12.41 14.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.812 -173.328 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.451 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 20.2 p -171.68 19.36 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 77.9 mt 60.08 16.35 5.86 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 176.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.451 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 27.6 mm-40 -97.0 173.28 7.36 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.564 0.221 . . . . 0.0 111.105 -177.016 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -69.83 153.52 43.2 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 116.172 -0.467 . . . . 0.0 112.087 -175.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.477 HG22 ' HB3' ' A' ' 15' ' ' GLN . 4.3 mt -150.32 131.53 4.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 123.558 0.743 . . . . 0.0 109.431 172.136 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 52.3 m80 -114.46 168.85 9.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.83 177.067 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 14.5 t -70.23 -17.2 63.13 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.656 -175.268 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.7 p -69.32 133.12 47.46 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.644 177.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.689 ' HD2' ' H ' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -97.74 11.14 38.17 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.383 -176.915 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 64.0 t -58.67 -50.05 80.49 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-O 120.954 0.407 . . . . 0.0 110.289 178.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 49.4 t -100.95 -32.77 3.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.073 177.049 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.597 ' HA ' ' HA ' ' A' ' 41' ' ' HIS . . . -86.72 104.54 16.21 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.285 -178.293 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.2 t60 -65.21 131.53 46.75 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.3 p -89.56 115.46 29.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.025 0.441 . . . . 0.0 110.743 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.632 HD12 ' HB2' ' A' ' 38' ' ' HIS . 86.6 mt -64.5 153.41 86.94 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.086 175.139 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -67.26 -10.59 29.15 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.27 1.98 . . . . 0.0 111.364 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 38.6 t -97.03 9.67 41.43 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.386 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.95 17.38 59.64 Favored Glycine 0 C--N 1.338 0.68 0 N-CA-C 114.33 0.492 . . . . 0.0 114.33 171.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.648 ' HB3' HD22 ' A' ' 57' ' ' LEU . 25.4 m-70 -103.84 156.08 18.11 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 117.499 0.649 . . . . 0.0 110.945 178.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 71.5 mt -112.9 135.92 53.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.946 0.403 . . . . 0.0 110.95 176.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.515 HD21 HD11 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -155.09 137.0 14.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.11 173.654 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 31' ' ' ALA . 0.0 OUTLIER -58.0 163.48 2.75 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.884 0.374 . . . . 0.0 111.934 -177.952 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.45 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 16.1 mmm180 -37.59 -69.01 0.13 Allowed 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 114.463 -1.244 . . . . 0.0 113.204 -174.301 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 53.3 m -63.22 -35.74 81.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.005 0.431 . . . . 0.0 111.292 -174.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.499 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -68.45 -24.05 64.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.175 -177.284 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.45 ' HB3' ' O ' ' A' ' 42' ' ' ARG . 30.1 t80 -60.82 -43.71 97.86 Favored 'General case' 0 C--O 1.232 0.179 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 173.191 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.454 ' HB3' ' HE2' ' A' ' 50' ' ' LYS . 41.6 mt-10 -64.43 -48.46 75.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.091 177.408 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.574 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 43.6 mt-10 -54.04 -57.01 12.65 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.501 -176.184 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 11.4 ttp -63.96 -47.72 79.31 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.064 0.459 . . . . 0.0 110.574 -175.125 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.0 tp -61.73 -38.16 86.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.284 -175.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.454 ' HE2' ' HB3' ' A' ' 46' ' ' GLU . 68.9 mttm -71.25 -35.37 71.4 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.57 0.224 . . . . 0.0 111.017 -179.39 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.574 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 8.1 mm-40 -59.52 -31.59 69.53 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.004 0.43 . . . . 0.0 110.487 178.053 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.59 -4.34 60.55 Favored Glycine 0 CA--C 1.518 0.261 0 CA-C-N 115.797 -0.638 . . . . 0.0 114.065 171.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -73.12 166.75 22.51 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 117.677 0.738 . . . . 0.0 110.723 179.2 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 63.3 mtm180 -65.44 135.62 55.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.246 -0.434 . . . . 0.0 109.89 177.002 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 0.9 OUTLIER -54.14 109.72 1.69 Allowed Pre-proline 0 C--N 1.327 -0.37 0 O-C-N 123.304 0.377 . . . . 0.0 112.01 -178.195 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -66.49 -17.62 53.56 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.64 2.226 . . . . 0.0 111.877 -178.526 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.648 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -70.82 -8.71 54.49 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.177 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.5 OUTLIER -70.81 -22.09 62.39 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.292 0.568 . . . . 0.0 109.85 174.245 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.567 ' SD ' ' N ' ' A' ' 59' ' ' MET . 1.1 mpt? -105.93 8.77 32.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.019 179.18 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -157.75 96.92 1.53 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.952 -174.024 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 71.1 m . . . . . 0 C--O 1.247 0.969 0 CA-C-O 118.599 -0.715 . . . . 0.0 109.779 176.836 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 . . . . . 0 N--CA 1.48 1.071 0 CA-C-O 120.693 0.282 . . . . 0.0 110.38 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -177.26 126.58 0.15 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.738 179.472 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 65.2 t -76.7 89.39 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.1 0.476 . . . . 0.0 110.554 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 65.1 p -168.21 118.71 0.79 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.744 177.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 23.7 mp0 -64.08 -43.22 96.06 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 178.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 67.0 mm-40 -141.84 164.03 31.29 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.257 174.381 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 -136.61 150.5 48.58 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.256 -0.429 . . . . 0.0 109.995 -179.358 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.635 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 13.4 t -96.78 110.52 53.82 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.134 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -68.63 -20.82 40.22 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.188 1.925 . . . . 0.0 111.097 175.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.635 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 19.3 mm -63.67 -25.51 38.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.241 -177.201 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.48 ' SG ' ' CG ' ' A' ' 22' ' ' GLU . 18.7 p -166.42 25.41 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.709 0.29 . . . . 0.0 111.597 -179.336 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 61.1 mt 54.78 21.96 3.88 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 112.867 0.692 . . . . 0.0 112.867 176.158 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.48 ' CG ' ' SG ' ' A' ' 20' ' ' CYS . 35.5 mm-40 -93.17 162.58 13.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.732 0.301 . . . . 0.0 110.962 -178.32 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -62.94 151.67 38.78 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.801 -179.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.2 mt -148.6 124.13 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.41 173.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -105.07 172.03 7.01 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 110.083 -0.339 . . . . 0.0 110.083 175.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.4 m -71.32 -18.75 62.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.724 -174.067 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.484 ' OG ' HG12 ' A' ' 29' ' ' VAL . 20.6 t -58.23 106.81 0.41 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 120.961 0.41 . . . . 0.0 110.87 -179.45 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.5 8.21 17.27 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.212 -175.407 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.484 HG12 ' OG ' ' A' ' 27' ' ' SER . 14.6 p -81.94 -38.95 16.21 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-O 121.006 0.432 . . . . 0.0 109.836 174.701 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.4 p -94.22 -44.46 13.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.013 177.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -87.47 97.9 11.09 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 175.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 8.8 t60 -58.49 127.36 31.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.498 -176.491 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.1 p -81.97 114.31 22.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.134 0.493 . . . . 0.0 110.736 179.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.623 HD12 ' HB2' ' A' ' 38' ' ' HIS . 76.8 mt -65.17 152.8 90.79 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.147 174.433 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.44 -3.65 12.24 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.348 2.032 . . . . 0.0 111.287 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 36.1 t -105.49 10.11 33.32 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.278 178.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 87.57 16.01 60.89 Favored Glycine 0 C--N 1.339 0.706 0 N-CA-C 114.92 0.728 . . . . 0.0 114.92 170.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.624 ' HB3' HD22 ' A' ' 57' ' ' LEU . 43.8 m-70 -104.3 156.5 17.86 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 117.759 0.779 . . . . 0.0 110.84 177.828 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 95.4 mt -113.3 137.19 51.86 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 122.533 0.333 . . . . 0.0 110.717 177.102 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.523 HD21 HD11 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -156.24 141.05 17.1 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.251 174.326 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.535 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -55.72 159.34 3.08 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.915 0.388 . . . . 0.0 111.701 179.71 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.515 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 21.5 mmt85 -42.4 -66.07 0.4 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 114.856 -1.065 . . . . 0.0 112.999 -172.217 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 25.2 m -61.67 -37.91 85.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.913 0.387 . . . . 0.0 111.056 -174.267 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.535 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -66.72 -26.83 67.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.945 179.852 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.515 ' HB3' ' O ' ' A' ' 42' ' ' ARG . 38.2 t80 -63.7 -48.61 76.39 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 174.071 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -61.74 -43.78 98.19 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.171 179.033 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.556 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 79.2 mm-40 -57.93 -56.58 20.16 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.844 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 8.5 ttp -61.52 -44.56 96.84 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.097 0.475 . . . . 0.0 110.411 -175.304 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 49.2 tp -66.39 -32.02 73.15 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.297 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.3 ttpp -68.64 -42.91 77.33 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.56 177.166 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.556 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 30.2 mm-40 -65.58 -37.81 87.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.836 177.522 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 64.8 39.09 96.35 Favored Glycine 0 C--N 1.333 0.379 0 CA-C-N 115.589 -0.732 . . . . 0.0 113.132 176.064 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 6.3 p90 -106.62 177.46 4.85 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.645 0.259 . . . . 0.0 110.693 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 34.6 mmt180 -64.39 119.18 9.87 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.004 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.455 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 0.8 OUTLIER -55.63 107.83 1.0 Allowed Pre-proline 0 CA--C 1.532 0.26 0 O-C-N 123.333 0.396 . . . . 0.0 111.513 -179.169 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -63.8 -21.18 69.41 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 122.697 2.265 . . . . 0.0 111.829 -175.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.624 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -69.48 -11.3 60.71 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.434 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.1 OUTLIER -68.18 -19.07 64.75 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.159 0.504 . . . . 0.0 110.211 176.353 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 86.6 mtp -102.88 20.07 18.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.687 176.082 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 74.3 t60 -139.62 135.87 33.76 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.016 -176.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.0 m . . . . . 0 C--O 1.249 1.043 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.139 175.688 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 . . . . . 0 N--CA 1.481 1.098 0 CA-C-O 120.867 0.365 . . . . 0.0 110.574 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 39.7 t-20 -148.9 136.64 20.53 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 65.7 t -61.29 109.55 0.54 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-O 120.831 0.348 . . . . 0.0 110.748 -178.243 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.0 p -162.94 146.76 11.14 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.244 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -73.83 -65.28 0.85 Allowed 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 176.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -117.82 149.2 41.21 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 174.326 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -98.54 140.16 33.2 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.924 0.392 . . . . 0.0 110.082 -178.597 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.554 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 39.1 t -91.07 108.1 25.81 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.183 174.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -72.68 -12.55 26.76 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.206 1.937 . . . . 0.0 111.189 176.343 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.554 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 14.3 mm -71.34 -15.18 18.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.988 -178.427 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.427 ' SG ' ' CG ' ' A' ' 22' ' ' GLU . 18.0 p -173.55 22.49 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 179.413 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 88.1 mt 58.73 24.66 12.49 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 176.46 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.427 ' CG ' ' SG ' ' A' ' 20' ' ' CYS . 42.9 mm-40 -99.15 159.92 14.64 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.668 0.271 . . . . 0.0 111.43 -177.376 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.25 148.27 52.08 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.206 177.3 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.486 HD13 ' O ' ' A' ' 39' ' ' LEU . 7.4 mt -138.44 120.8 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-O 121.087 0.47 . . . . 0.0 110.558 174.415 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 23.2 m80 -99.18 175.22 5.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.983 174.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 49.3 p -75.29 -39.65 59.46 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -173.229 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 35.5 t -45.32 117.85 1.53 Allowed 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.459 0.474 . . . . 0.0 112.202 -173.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.48 ' HA ' ' O ' ' A' ' 31' ' ' ALA . 0.0 OUTLIER -60.51 -20.83 61.43 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.053 179.463 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.2 t -57.55 -47.92 84.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-O 120.988 0.423 . . . . 0.0 110.397 179.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.525 ' O ' ' HA ' ' A' ' 41' ' ' HIS . 60.0 t -91.32 -50.59 12.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.324 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.544 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -99.79 102.78 14.31 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.06 -177.455 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.6 t60 -66.45 138.65 57.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.755 176.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 8.6 p -90.73 122.32 41.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-O 121.293 0.568 . . . . 0.0 111.254 -178.437 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.64 HD12 ' HB2' ' A' ' 38' ' ' HIS . 70.1 mt -72.28 154.56 92.0 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.615 174.324 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -58.03 -24.18 64.31 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 122.621 2.214 . . . . 0.0 112.201 177.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 48.0 t -89.72 9.03 28.71 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.575 -178.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.74 22.43 53.3 Favored Glycine 0 C--N 1.337 0.594 0 C-N-CA 121.415 -0.422 . . . . 0.0 113.665 173.004 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.64 ' HB2' HD12 ' A' ' 34' ' ' LEU . 71.4 m-70 -101.37 157.26 16.93 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 122.449 -0.442 . . . . 0.0 110.95 177.944 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.544 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 95.1 mt -112.56 137.38 50.87 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.982 174.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.529 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -154.28 142.83 20.73 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 174.205 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.525 ' HA ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -62.94 159.86 16.03 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.778 0.323 . . . . 0.0 111.576 -179.88 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.532 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 24.9 mmm180 -37.39 -67.64 0.18 Allowed 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 114.772 -1.104 . . . . 0.0 113.378 -174.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 89.4 m -60.95 -42.46 98.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.929 0.395 . . . . 0.0 111.154 -175.46 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.5 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -63.28 -25.73 68.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.078 -177.514 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.532 ' HB3' ' O ' ' A' ' 42' ' ' ARG . 44.3 t80 -60.13 -47.02 87.66 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 174.626 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -67.23 -42.73 83.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.183 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -54.93 -55.28 32.4 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.291 -178.091 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 15.5 ttp -68.64 -48.09 64.94 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.72 -175.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 39.2 tp -64.82 -28.95 69.91 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.858 -176.207 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -62.67 -43.31 99.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.263 0.554 . . . . 0.0 110.107 177.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -75.61 -38.45 59.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.713 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 67.32 28.4 73.67 Favored Glycine 0 CA--C 1.519 0.314 0 CA-C-N 115.857 -0.611 . . . . 0.0 112.776 178.176 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 17.1 p90 -85.11 176.89 8.12 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.42 ' O ' ' HD3' ' A' ' 56' ' ' PRO . 19.7 ptp180 -59.17 136.29 57.91 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 -179.331 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.5 p -72.62 107.15 2.73 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-O 120.615 0.245 . . . . 0.0 111.57 -177.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.42 ' HD3' ' O ' ' A' ' 54' ' ' ARG . 48.7 Cg_endo -67.45 -18.47 49.36 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.585 2.19 . . . . 0.0 111.927 -176.356 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.575 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -69.78 -15.67 63.16 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.553 -179.447 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.84 -30.63 71.64 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.984 0.421 . . . . 0.0 110.197 176.011 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 23.5 ptp -110.04 -2.83 16.81 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.334 -178.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 57.8 m80 -143.11 118.18 10.07 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.613 0.244 . . . . 0.0 110.745 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 55.7 m . . . . . 0 C--O 1.254 1.325 0 CA-C-O 118.407 -0.806 . . . . 0.0 109.647 177.307 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 . . . . . 0 N--CA 1.484 1.236 0 CA-C-O 120.537 0.208 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -138.24 91.38 2.55 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.4 0.619 . . . . 0.0 110.803 -177.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.9 m -115.49 79.15 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.157 176.379 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.3 m -67.18 -31.88 72.6 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.082 -177.375 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -71.47 88.67 0.92 Allowed 'General case' 0 C--O 1.237 0.403 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 173.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -61.56 150.71 35.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.733 -169.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -96.34 151.94 19.06 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.4 174.182 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.433 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 40.7 t -96.76 107.64 38.11 Favored Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 110.224 -0.287 . . . . 0.0 110.224 177.475 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.15 -16.01 28.61 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.165 1.91 . . . . 0.0 111.447 178.676 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.433 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 17.2 mm -64.01 -27.2 42.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.746 -179.189 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.435 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 23.3 p -157.57 16.96 0.26 Allowed 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.345 -178.341 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 88.9 mt 55.89 29.26 13.84 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.053 0.541 . . . . 0.0 112.351 178.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.435 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 35.2 mm-40 -105.98 174.88 5.69 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.152 0.501 . . . . 0.0 111.933 -178.141 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -71.84 148.51 46.12 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.099 -0.955 . . . . 0.0 112.48 -174.095 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.405 HD11 ' HA ' ' A' ' 40' ' ' LEU . 6.2 mt -149.19 149.1 15.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 123.695 0.798 . . . . 0.0 109.04 174.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 45.1 m-70 -120.93 150.1 41.61 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 110.0 -0.371 . . . . 0.0 110.0 179.04 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.6 m -63.52 -17.4 62.75 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.25 -0.432 . . . . 0.0 112.078 -174.62 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.4 m -66.21 111.4 3.43 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.931 0.396 . . . . 0.0 110.932 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.473 ' HG2' HD21 ' A' ' 39' ' ' LEU . 64.8 mtm180 -72.82 -9.4 58.63 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.291 -176.496 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.9 p -71.32 -32.5 47.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.234 178.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.4 p -94.13 -36.35 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 CA-C-O 120.764 0.316 . . . . 0.0 111.227 -177.522 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -101.69 144.25 30.63 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.579 -178.773 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -72.31 131.77 43.13 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.082 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.405 ' HA ' HD23 ' A' ' 39' ' ' LEU . 7.3 p -93.46 124.55 45.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.065 0.459 . . . . 0.0 111.662 -175.794 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.706 HD12 ' HB2' ' A' ' 38' ' ' HIS . 55.0 mt -81.23 152.84 71.37 Favored Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.624 173.511 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -71.59 -2.59 11.58 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.734 2.289 . . . . 0.0 112.096 -178.255 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 46.6 t -104.04 9.27 36.54 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.068 176.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.3 23.14 49.24 Favored Glycine 0 C--N 1.336 0.563 0 CA-C-N 116.073 -0.512 . . . . 0.0 113.445 172.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.706 ' HB2' HD12 ' A' ' 34' ' ' LEU . 50.9 m-70 -104.19 156.01 18.25 Favored 'General case' 0 C--N 1.328 -0.335 0 O-C-N 122.538 -0.39 . . . . 0.0 111.239 177.763 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.473 HD21 ' HG2' ' A' ' 28' ' ' ARG . 60.7 mt -117.35 141.13 48.69 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.318 174.476 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.581 HD21 HD11 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -157.48 146.57 19.84 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.303 175.225 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.467 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -60.15 159.69 9.31 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.814 0.34 . . . . 0.0 111.071 179.794 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.447 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 21.7 mmt180 -47.37 -55.54 8.67 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.072 -0.967 . . . . 0.0 112.684 -168.528 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.41 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 60.5 m -65.71 -48.08 73.2 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 120.742 0.306 . . . . 0.0 111.149 -177.739 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.467 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -56.39 -28.2 58.53 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.164 -178.202 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.541 ' HB2' HD13 ' A' ' 40' ' ' LEU . 60.5 t80 -59.32 -53.04 62.76 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.263 0.554 . . . . 0.0 109.935 174.643 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -65.1 -36.47 84.42 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.673 -176.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 43' ' ' THR . 42.0 mt-10 -61.82 -54.92 35.58 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.816 -179.144 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 25.6 ttp -64.32 -44.76 90.53 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.962 0.41 . . . . 0.0 110.284 -178.237 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 55.9 tp -63.69 -34.79 78.63 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.829 -178.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.8 ttpp -60.49 -46.53 89.78 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.098 0.475 . . . . 0.0 109.99 177.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -66.79 -35.1 79.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.079 177.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 62.2 33.78 87.02 Favored Glycine 0 C--N 1.333 0.402 0 CA-C-N 115.626 -0.716 . . . . 0.0 112.866 176.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -96.75 176.1 6.12 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.631 0.216 . . . . 0.0 110.452 179.6 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.8 mtm180 -58.28 123.11 14.95 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.904 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.4 p -53.91 108.28 1.08 Allowed Pre-proline 0 CA--C 1.533 0.299 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.804 -179.601 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.06 -16.85 57.23 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 122.89 2.393 . . . . 0.0 112.859 -174.586 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.58 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.8 mp -70.45 -16.82 62.97 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 121.054 0.454 . . . . 0.0 110.315 178.898 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -74.69 -20.2 59.95 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.226 173.321 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.573 ' SD ' ' N ' ' A' ' 59' ' ' MET . 1.1 mpt? -94.81 -47.81 6.3 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.26 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -142.15 115.05 8.68 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.765 -177.797 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 12.9 t . . . . . 0 C--O 1.25 1.116 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 176.614 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 . . . . . 0 N--CA 1.48 1.059 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 69.44 89.2 0.1 Allowed 'General case' 0 N--CA 1.466 0.336 0 O-C-N 123.857 0.723 . . . . 0.0 110.413 -178.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 30.4 m -127.1 129.42 71.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.326 179.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.4 m -73.27 145.99 45.71 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.155 177.336 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -53.65 -48.81 69.05 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 173.187 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 56.2 tp60 -142.44 141.98 32.28 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.563 -1.198 . . . . 0.0 108.268 168.174 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -96.87 136.7 37.05 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.801 0.334 . . . . 0.0 110.475 -178.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.5 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 18.2 t -87.08 110.03 29.82 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.077 171.688 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -74.85 -18.45 19.12 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.508 2.139 . . . . 0.0 110.896 176.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.5 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 15.9 mm -61.7 -25.56 37.29 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.377 -175.204 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.467 ' SG ' ' HG3' ' A' ' 22' ' ' GLU . 18.3 p -164.81 18.22 0.05 Allowed 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.266 -177.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 80.6 mt 49.91 83.68 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.21 0.529 . . . . 0.0 111.642 -175.596 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.467 ' HG3' ' SG ' ' A' ' 20' ' ' CYS . 35.3 mt-10 -144.95 155.7 43.56 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.811 176.635 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -71.91 141.31 49.51 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 123.693 0.621 . . . . 0.0 110.512 175.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 10.0 mt -136.32 136.47 48.98 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.604 176.815 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -113.88 145.33 41.62 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.138 177.294 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.8 m -59.28 -15.91 18.52 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -173.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.8 m -45.47 108.52 0.13 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.288 0.566 . . . . 0.0 111.049 177.778 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -69.63 -30.01 67.63 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.532 -165.365 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 45.8 t -76.28 -19.71 15.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.888 0.375 . . . . 0.0 111.211 -174.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 94.3 t -99.8 -46.62 12.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.09 -179.564 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.35 113.37 23.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.197 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 46.0 t-80 -65.97 138.14 57.62 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.972 -178.404 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.3 p -93.8 131.53 40.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.271 0.558 . . . . 0.0 111.997 -176.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.676 HD12 ' HB2' ' A' ' 38' ' ' HIS . 60.4 mt -81.79 146.36 56.09 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.302 169.6 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -55.9 -20.85 30.98 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 122.591 2.194 . . . . 0.0 112.107 177.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.3 t -92.54 10.3 30.86 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.646 -177.386 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.59 17.91 59.4 Favored Glycine 0 C--N 1.337 0.61 0 N-CA-C 114.372 0.509 . . . . 0.0 114.372 170.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.676 ' HB2' HD12 ' A' ' 34' ' ' LEU . 47.3 m-70 -103.37 157.33 17.1 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 117.489 0.645 . . . . 0.0 110.671 177.673 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 91.6 mt -113.45 140.0 48.46 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.878 0.371 . . . . 0.0 110.881 177.126 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.512 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -152.33 159.18 43.5 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.733 176.476 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.459 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -71.95 168.83 17.17 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.65 0.262 . . . . 0.0 111.066 179.527 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 25.4 mmt180 -44.31 -62.26 1.23 Allowed 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.158 -0.928 . . . . 0.0 112.005 -174.269 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.6 m -64.77 -49.43 70.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.381 -175.071 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.459 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -56.47 -27.06 55.94 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.921 -0.581 . . . . 0.0 112.072 -176.003 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.512 ' HB2' HD13 ' A' ' 40' ' ' LEU . 42.4 t80 -58.18 -51.18 70.82 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.691 0.757 . . . . 0.0 109.64 173.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -71.81 -39.1 70.08 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.446 -1.252 . . . . 0.0 110.642 -176.293 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.48 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 42.5 mt-10 -57.7 -56.41 22.34 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.627 179.008 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 19.8 ttp -63.25 -45.11 93.07 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.127 -176.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 29.0 tp -66.45 -31.24 71.87 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.934 -176.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.3 ttpp -68.8 -48.27 64.04 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.121 178.327 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 6.2 mm-40 -64.76 -36.38 84.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.067 178.541 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.13 29.82 68.29 Favored Glycine 0 C--N 1.332 0.339 0 CA-C-N 115.604 -0.726 . . . . 0.0 113.626 173.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.431 ' CD1' ' HB2' ' A' ' 51' ' ' GLU . 39.0 p90 -89.18 169.81 11.14 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 117.045 0.423 . . . . 0.0 110.639 178.202 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 55.6 mtp180 -63.79 125.86 25.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.62 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -55.68 108.8 1.29 Allowed Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.838 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -65.61 -17.44 56.92 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 122.852 2.368 . . . . 0.0 112.389 -177.382 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.601 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -72.47 -8.43 55.03 Favored 'General case' 0 CA--C 1.528 0.112 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.545 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.98 -24.04 61.52 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.837 0.351 . . . . 0.0 110.563 177.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 14.7 tmm? -71.15 -28.08 64.01 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.222 176.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -65.75 156.2 33.82 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.815 -178.783 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.4 t . . . . . 0 C--O 1.252 1.21 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 177.618 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 . . . . . 0 N--CA 1.48 1.034 0 CA-C-O 120.786 0.327 . . . . 0.0 110.345 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -110.1 30.67 6.52 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.428 0.632 . . . . 0.0 110.004 175.274 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 47.9 t -71.92 82.95 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.202 -178.796 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 17.0 m -84.18 -17.3 40.39 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.56 0.695 . . . . 0.0 109.473 177.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 21.6 mp0 -78.97 99.56 6.89 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.085 -178.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.423 ' O ' ' HB ' ' A' ' 24' ' ' ILE . 29.9 tt0 -60.56 113.07 2.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.55 176.25 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.406 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 33.4 p30 -76.87 152.08 35.57 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.522 0.677 . . . . 0.0 111.565 -173.705 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 10.5 t -87.79 108.46 20.86 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.481 172.608 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.406 ' HD3' ' O ' ' A' ' 16' ' ' ASN . 22.4 Cg_exo -63.54 -28.89 70.39 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.407 2.071 . . . . 0.0 111.26 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 8.5 mm -57.14 -23.09 17.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.759 -173.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.4 p -158.08 14.76 0.21 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 120.702 0.287 . . . . 0.0 110.937 178.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 90.3 mt 45.9 67.55 0.73 Allowed 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.543 0.687 . . . . 0.0 111.618 -176.205 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -136.06 -177.92 4.91 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 114.986 -1.006 . . . . 0.0 109.971 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -77.54 151.93 34.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.882 0.372 . . . . 0.0 111.641 -177.275 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.474 HD11 ' HA ' ' A' ' 40' ' ' LEU . 2.9 mt -147.72 146.08 18.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.274 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.333 172.505 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.413 ' CG ' ' H ' ' A' ' 26' ' ' THR . 3.5 t-160 -127.69 -178.66 4.57 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.448 0.166 . . . . 0.0 110.762 -177.485 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.413 ' H ' ' CG ' ' A' ' 25' ' ' HIS . 6.3 m -72.61 -33.2 66.53 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -167.195 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.5 t -59.08 117.59 4.88 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 120.894 0.378 . . . . 0.0 112.002 -171.312 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.557 ' HG3' HD21 ' A' ' 39' ' ' LEU . 6.8 mpt_? -76.8 -6.9 54.18 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.897 176.511 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.5 t -87.17 -35.02 7.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.698 178.143 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.1 t -81.4 -55.26 8.39 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.883 176.447 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -94.66 125.38 39.27 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.697 177.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -67.89 133.03 48.44 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 -178.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.7 p -87.57 116.62 30.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-O 121.106 0.479 . . . . 0.0 111.008 179.228 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.567 HD12 ' HB2' ' A' ' 38' ' ' HIS . 73.3 mt -65.7 155.42 86.14 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.462 175.396 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.26 -14.76 25.73 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.791 2.327 . . . . 0.0 112.423 178.326 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 48.9 t -101.57 11.02 39.7 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.78 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 83.45 22.22 56.87 Favored Glycine 0 C--N 1.335 0.511 0 CA-C-N 116.224 -0.444 . . . . 0.0 114.153 171.697 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.626 ' HB3' HD22 ' A' ' 57' ' ' LEU . 48.7 m-70 -103.01 156.66 17.52 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 117.281 0.54 . . . . 0.0 110.909 177.406 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.557 HD21 ' HG3' ' A' ' 28' ' ' ARG . 80.4 mt -113.11 141.25 47.13 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.865 0.364 . . . . 0.0 110.79 177.774 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.545 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -157.85 150.15 22.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.949 175.263 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.49 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -64.64 165.33 10.42 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.703 0.287 . . . . 0.0 111.433 179.339 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.457 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 10.0 mmm180 -48.88 -66.26 0.43 Allowed 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.121 -0.945 . . . . 0.0 112.876 -171.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 48.1 m -58.06 -40.89 82.14 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.962 0.41 . . . . 0.0 110.842 -175.542 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.49 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.5 OUTLIER -65.94 -29.57 70.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.81 179.755 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.545 ' HB2' HD13 ' A' ' 40' ' ' LEU . 20.8 t80 -63.46 -55.6 22.88 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.394 178.194 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -59.24 -49.4 77.98 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.967 -175.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.428 ' HA ' ' HD3' ' A' ' 50' ' ' LYS . 7.3 mm-40 -57.19 -43.34 82.61 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.988 -178.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.436 ' SD ' ' C ' ' A' ' 48' ' ' MET . 0.7 OUTLIER -68.72 -44.48 73.79 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 121.069 0.462 . . . . 0.0 110.358 178.898 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.484 ' O ' HD13 ' A' ' 49' ' ' LEU . 2.3 tm? -66.2 -33.66 76.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.625 -174.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 46.6 mtpt -59.15 -34.36 71.99 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.968 178.663 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.421 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 42.6 mt-10 -96.15 -38.72 10.04 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.983 -177.438 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 65.12 26.95 71.77 Favored Glycine 0 CA--C 1.518 0.261 0 CA-C-N 115.99 -0.55 . . . . 0.0 112.375 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.421 ' HD1' ' HB2' ' A' ' 51' ' ' GLU . 33.7 p90 -70.71 177.92 3.32 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 122.425 0.29 . . . . 0.0 111.166 -177.5 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.427 ' O ' ' HD3' ' A' ' 56' ' ' PRO . 15.2 mmt180 -56.65 121.57 10.05 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.837 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.2 p -73.46 105.83 1.93 Allowed Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.413 -178.337 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.427 ' HD3' ' O ' ' A' ' 54' ' ' ARG . 46.4 Cg_endo -66.8 -13.79 41.28 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 122.58 2.187 . . . . 0.0 112.156 -176.655 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.626 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -73.54 -14.94 61.3 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.296 179.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.53 -24.48 67.62 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.459 177.836 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -71.95 -25.64 61.95 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.783 179.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 17.7 t60 -111.3 142.83 43.01 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.593 -177.547 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 7.9 p . . . . . 0 C--O 1.253 1.251 0 CA-C-O 118.457 -0.782 . . . . 0.0 110.228 175.419 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 . . . . . 0 N--CA 1.482 1.137 0 N-CA-C 111.357 0.132 . . . . 0.0 111.357 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.9 p-10 -69.1 139.46 54.77 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.974 0.416 . . . . 0.0 111.043 -176.112 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.411 ' HB ' ' HG2' ' A' ' 14' ' ' GLN . 35.2 m -125.75 148.13 30.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.19 177.316 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.5 t -104.91 21.47 16.95 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.21 0.529 . . . . 0.0 109.969 -179.176 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.411 ' HG2' ' HB ' ' A' ' 12' ' ' VAL . 13.8 pt20 -118.46 173.74 6.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.349 -178.023 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.506 ' HB2' ' O ' ' A' ' 24' ' ' ILE . 1.7 mp0 -88.2 172.48 9.44 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 172.752 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 39.9 p30 -150.81 161.48 42.59 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.163 0.506 . . . . 0.0 111.108 -179.206 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.465 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 44.8 t -108.79 108.16 60.57 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.593 172.377 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -74.01 -14.97 23.59 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.264 1.976 . . . . 0.0 111.469 177.579 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.465 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 23.3 mm -64.44 -24.13 34.96 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.046 -177.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.0 p -161.16 10.81 0.09 Allowed 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 -177.594 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 9.3 mp 54.76 94.12 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.314 0.578 . . . . 0.0 110.569 -172.359 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -160.02 164.35 33.28 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.859 -178.069 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -73.83 137.55 43.87 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.734 -179.395 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.506 ' O ' ' HB2' ' A' ' 15' ' ' GLN . 5.2 mt -141.12 148.33 21.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 174.867 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -134.98 166.0 24.04 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.0 m -52.06 -17.03 0.89 Allowed 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 122.994 0.518 . . . . 0.0 112.05 177.378 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.3 m -48.73 86.79 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.328 0.651 . . . . 0.0 111.882 179.192 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 50.2 ttp180 -81.1 -4.95 56.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.894 -176.505 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 47.9 t -80.27 -36.84 16.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.267 0.556 . . . . 0.0 109.741 175.42 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.2 t -88.65 -54.41 7.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.531 177.37 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.94 117.83 18.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.123 -179.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 48.4 t60 -69.52 127.56 33.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.036 -179.368 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.9 p -88.45 118.6 34.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.245 0.545 . . . . 0.0 111.284 -177.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.586 HD12 ' HB2' ' A' ' 38' ' ' HIS . 92.7 mt -62.81 150.4 87.4 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.755 172.845 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -59.05 -12.76 16.52 Favored 'Trans proline' 0 CA--C 1.535 0.537 0 C-N-CA 122.712 2.275 . . . . 0.0 112.953 177.691 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.3 t -96.91 6.69 48.18 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.77 0.319 . . . . 0.0 110.801 178.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.14 19.99 47.94 Favored Glycine 0 C--N 1.337 0.632 0 N-CA-C 114.286 0.474 . . . . 0.0 114.286 172.387 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.607 ' HB3' HD22 ' A' ' 57' ' ' LEU . 39.9 m-70 -104.0 156.87 17.51 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 117.505 0.652 . . . . 0.0 110.981 178.01 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.6 mt -113.65 137.07 52.12 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.79 0.328 . . . . 0.0 111.189 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.578 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -157.24 157.5 34.41 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.859 174.661 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.492 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -72.31 166.65 22.04 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.174 -179.693 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.495 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 26.3 mmm180 -49.13 -64.02 0.93 Allowed 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -172.746 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.489 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 27.2 m -60.56 -41.56 94.82 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.572 0.225 . . . . 0.0 110.628 -175.432 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.492 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -62.34 -27.57 69.15 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 120.884 0.373 . . . . 0.0 110.479 178.535 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.578 ' HB2' HD13 ' A' ' 40' ' ' LEU . 25.0 t80 -70.74 -44.76 66.13 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.933 174.816 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.41 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 42.7 mt-10 -66.9 -27.9 67.87 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.677 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.489 ' HG3' ' O ' ' A' ' 43' ' ' THR . 43.9 mt-10 -73.21 -51.79 16.46 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.24 175.136 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.446 ' C ' ' SD ' ' A' ' 48' ' ' MET . 0.6 OUTLIER -62.32 -54.27 42.94 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.894 -176.776 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 65.6 tp -61.72 -28.44 69.42 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.095 -177.603 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.534 ' HB2' ' NZ ' ' A' ' 50' ' ' LYS . 4.6 ttmp? -61.49 -40.63 95.29 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.057 0.456 . . . . 0.0 110.579 178.475 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.423 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 19.8 mm-40 -88.25 -33.12 18.19 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.011 -178.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 61.64 29.95 73.41 Favored Glycine 0 C--N 1.334 0.466 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.307 -178.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.493 ' HB2' ' NH1' ' A' ' 54' ' ' ARG . 16.0 p90 -82.52 174.04 11.43 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 120.806 0.336 . . . . 0.0 111.154 -175.351 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.493 ' NH1' ' HB2' ' A' ' 53' ' ' TYR . 0.3 OUTLIER -57.44 138.79 54.62 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.747 177.939 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.403 ' HA ' ' HD2' ' A' ' 56' ' ' PRO . 0.9 OUTLIER -90.37 107.17 18.08 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -175.353 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 55' ' ' CYS . 33.5 Cg_endo -63.63 -15.0 46.07 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.781 2.321 . . . . 0.0 112.192 179.461 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.607 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.9 mp -75.38 -6.64 51.01 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.418 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -73.11 -34.86 66.4 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.014 0.435 . . . . 0.0 109.869 173.172 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 23.5 ttt -73.29 -49.33 28.18 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.299 176.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 80.2 t60 -72.45 139.13 47.55 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.918 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.5 m . . . . . 0 C--O 1.251 1.163 0 CA-C-O 118.614 -0.707 . . . . 0.0 110.148 178.884 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 . . . . . 0 N--CA 1.484 1.249 0 CA-C-O 121.114 0.483 . . . . 0.0 110.586 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.514 ' HA ' HE22 ' A' ' 14' ' ' GLN . 2.4 m-20 -77.2 77.69 3.73 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.764 -178.116 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 54.8 t -73.75 -77.13 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 176.222 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.7 m -157.55 98.22 1.66 Allowed 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.367 177.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.514 HE22 ' HA ' ' A' ' 11' ' ' ASN . 21.8 mp0 -76.24 136.65 39.68 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.706 175.614 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.552 ' O ' ' HB ' ' A' ' 24' ' ' ILE . 15.0 mm100 -62.41 111.06 1.86 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.907 0.384 . . . . 0.0 110.72 178.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.401 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 8.4 p30 -80.92 151.03 28.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.778 178.147 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.51 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 22.1 t -82.92 108.78 13.54 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.365 177.324 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.41 ' HG3' ' HG ' ' A' ' 57' ' ' LEU . 73.3 Cg_endo -74.89 -7.42 19.23 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.269 1.979 . . . . 0.0 111.437 179.492 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.51 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 21.3 mm -72.3 -22.98 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.41 178.793 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.679 ' SG ' ' HG3' ' A' ' 22' ' ' GLU . 21.3 p -163.09 22.62 0.09 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 120.726 0.298 . . . . 0.0 111.574 -179.528 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.406 HD12 ' N ' ' A' ' 21' ' ' LEU . 7.1 mp 57.32 25.93 11.79 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 174.479 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.679 ' HG3' ' SG ' ' A' ' 20' ' ' CYS . 54.0 mt-10 -93.28 -179.42 5.06 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 120.712 0.291 . . . . 0.0 110.62 178.257 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -90.39 149.53 22.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.406 177.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.552 ' HB ' ' O ' ' A' ' 15' ' ' GLN . 6.4 mt -137.08 137.19 46.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 175.497 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 18.3 t60 -111.82 156.47 21.93 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 -177.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.5 t -56.7 -16.96 7.3 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -177.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.0 t -61.65 93.88 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.137 0.494 . . . . 0.0 110.839 -178.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 50.0 ttp180 -76.61 -14.32 60.0 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.625 -178.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.8 p -68.57 -19.03 23.87 Favored 'Isoleucine or valine' 0 C--O 1.238 0.447 0 CA-C-O 121.473 0.654 . . . . 0.0 109.495 173.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 61.2 t -99.09 -63.14 1.72 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.533 173.032 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.77 123.05 21.77 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.21 -178.017 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -76.17 140.31 41.67 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.804 178.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.404 ' HA ' ' O ' ' A' ' 38' ' ' HIS . 7.5 p -98.05 120.13 46.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-O 121.183 0.516 . . . . 0.0 111.308 -179.421 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.628 HD12 ' HB2' ' A' ' 38' ' ' HIS . 84.6 mt -61.27 148.65 84.88 Favored Pre-proline 0 C--O 1.233 0.215 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.022 172.742 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -56.8 -19.68 32.27 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.595 2.197 . . . . 0.0 112.45 179.008 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 46.7 t -88.98 0.35 56.73 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.975 -178.387 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.35 19.33 28.24 Favored Glycine 0 C--N 1.335 0.502 0 C-N-CA 121.41 -0.424 . . . . 0.0 114.084 174.225 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.628 ' HB2' HD12 ' A' ' 34' ' ' LEU . 54.6 m-70 -103.32 156.62 17.6 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 117.424 0.612 . . . . 0.0 111.241 179.412 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.0 mt -112.98 139.8 48.33 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 120.848 0.356 . . . . 0.0 111.445 178.513 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.563 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -162.86 149.04 12.37 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.579 176.178 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.563 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -58.9 158.43 8.33 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.042 175.547 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.528 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 9.9 mmt85 -50.91 -58.24 6.5 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 115.729 -0.668 . . . . 0.0 112.241 -170.316 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.444 ' O ' ' HG2' ' A' ' 47' ' ' GLU . 26.6 m -55.84 -44.25 77.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.238 -177.716 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.563 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -62.44 -31.9 72.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.764 179.267 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.563 ' HB2' HD13 ' A' ' 40' ' ' LEU . 34.5 t80 -62.34 -47.67 83.19 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.845 175.554 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -62.35 -51.47 67.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.56 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 43' ' ' THR . 23.0 mm-40 -62.84 -37.18 85.78 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.583 -177.779 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.453 ' C ' ' SD ' ' A' ' 48' ' ' MET . 0.5 OUTLIER -67.89 -51.36 48.93 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.255 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.4 tp -66.64 -28.42 68.46 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.589 -179.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -57.5 -50.62 72.47 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.371 177.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.418 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 28.5 mm-40 -79.92 -32.73 40.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.46 178.807 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 61.8 32.86 83.29 Favored Glycine 0 C--N 1.331 0.276 0 CA-C-N 115.91 -0.587 . . . . 0.0 112.46 179.155 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.418 ' HD1' ' HB2' ' A' ' 51' ' ' GLU . 22.8 p90 -77.66 -175.93 4.1 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.858 0.361 . . . . 0.0 110.727 -179.365 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.528 ' H ' ' HD2' ' A' ' 54' ' ' ARG . 2.4 mpt_? -72.73 122.37 21.39 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -177.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.4 p -61.8 107.3 1.07 Allowed Pre-proline 0 C--N 1.329 -0.323 0 O-C-N 123.102 0.251 . . . . 0.0 111.273 -178.336 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -59.84 -28.9 88.26 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.748 2.299 . . . . 0.0 112.163 -173.34 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.574 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.6 mp -62.61 -16.81 58.42 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.952 0.406 . . . . 0.0 110.85 -177.161 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -74.73 -32.99 62.29 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.617 176.608 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 28.1 ttt -109.9 -23.12 11.53 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -174.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.437 ' O ' ' HA ' ' A' ' 57' ' ' LEU . 59.4 t-80 -151.38 151.51 31.83 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -174.311 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 31.6 t . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.178 -0.915 . . . . 0.0 109.29 176.571 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 . . . . . 0 N--CA 1.481 1.105 0 CA-C-O 120.498 0.19 . . . . 0.0 111.13 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -160.07 121.26 3.11 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 179.019 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 10.9 p -96.39 -19.31 6.21 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.198 -179.004 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 41.4 p -64.6 108.92 1.82 Allowed 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.055 0.455 . . . . 0.0 111.445 -176.647 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -155.45 155.02 32.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.374 175.359 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.476 ' HB2' HG22 ' A' ' 24' ' ' ILE . 83.8 mm-40 -121.85 154.06 37.55 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 -178.932 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 -112.3 144.29 41.96 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.836 0.35 . . . . 0.0 110.354 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.458 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 43.5 t -92.27 108.19 28.95 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.704 176.613 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.433 ' HG2' ' HG2' ' A' ' 56' ' ' PRO . 73.6 Cg_endo -76.52 -8.67 18.43 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.246 1.964 . . . . 0.0 111.617 177.135 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.458 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 20.6 mm -70.91 -23.12 23.43 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.943 -177.58 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.471 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 21.4 p -162.18 12.63 0.08 Allowed 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -177.391 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 7.5 mp 54.97 91.02 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.215 0.531 . . . . 0.0 109.92 -171.609 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.471 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 0.4 OUTLIER -155.37 167.48 30.24 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.361 -174.134 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -88.92 143.32 26.95 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.708 0.29 . . . . 0.0 110.401 179.272 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.476 HG22 ' HB2' ' A' ' 15' ' ' GLN . 11.4 mt -142.48 142.24 27.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -123.74 177.6 5.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.276 179.128 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 15.2 t -75.81 -15.82 60.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.593 -173.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.5 m -57.52 89.91 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 120.927 0.394 . . . . 0.0 111.224 179.396 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.505 ' HG2' HD21 ' A' ' 39' ' ' LEU . 82.8 mtt85 -71.81 -11.48 60.83 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.055 -177.78 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 66.6 t -66.74 -35.31 74.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.232 0.539 . . . . 0.0 109.994 173.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 40.0 t -94.08 -53.69 8.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.951 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -84.54 116.8 23.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.061 178.555 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -65.38 124.82 23.26 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.273 -177.856 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.492 ' HA ' HD23 ' A' ' 39' ' ' LEU . 7.3 p -80.73 116.94 25.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.099 0.476 . . . . 0.0 110.95 178.768 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.621 HD12 ' HB2' ' A' ' 38' ' ' HIS . 76.2 mt -65.98 154.91 88.42 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.046 174.149 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -67.99 -5.55 14.91 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.323 2.015 . . . . 0.0 111.475 178.197 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 30.2 t -106.03 14.49 27.76 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.402 178.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.66 2.53 75.69 Favored Glycine 0 C--N 1.341 0.846 0 N-CA-C 114.948 0.739 . . . . 0.0 114.948 169.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.621 ' HB2' HD12 ' A' ' 34' ' ' LEU . 25.9 m-70 -96.95 156.83 16.18 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 117.525 0.662 . . . . 0.0 111.339 -175.813 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.505 HD21 ' HG2' ' A' ' 28' ' ' ARG . 98.1 mt -114.0 142.57 46.0 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.876 178.616 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.528 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -157.04 152.12 26.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.862 175.872 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.512 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -66.15 167.82 9.48 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.991 178.761 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.509 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 15.4 mmm180 -50.17 -60.45 2.95 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.174 -169.233 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 28.3 m -66.22 -41.43 90.09 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.247 -175.609 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.512 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -60.8 -26.38 67.25 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 120.77 0.319 . . . . 0.0 110.694 -178.941 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.528 ' HB2' HD13 ' A' ' 40' ' ' LEU . 39.5 t80 -59.67 -48.84 80.1 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.008 174.566 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -65.82 -44.31 85.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.629 -179.73 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -57.8 -51.69 68.52 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.925 -178.003 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 9.5 tmm? -65.0 -49.39 70.43 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.19 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 54.1 tp -62.12 -31.1 71.53 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.103 -177.266 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.4 ttmm -63.58 -40.44 96.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.918 0.389 . . . . 0.0 110.272 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -75.62 -41.4 54.41 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.363 176.342 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.87 45.92 94.32 Favored Glycine 0 C--N 1.333 0.388 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 -176.092 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -102.91 -175.71 2.89 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.784 0.325 . . . . 0.0 110.513 -175.453 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.454 ' HG3' ' O ' ' A' ' 54' ' ' ARG . 34.8 ptt180 -56.78 110.6 0.83 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.296 177.707 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.422 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 0.8 OUTLIER -64.81 105.48 0.74 Allowed Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.731 -0.213 . . . . 0.0 110.646 178.936 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.433 ' HG2' ' HG2' ' A' ' 18' ' ' PRO . 22.3 Cg_endo -59.49 -22.51 66.66 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 122.806 2.337 . . . . 0.0 112.408 -172.493 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.561 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.3 mp -66.93 -20.55 65.92 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.518 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.7 OUTLIER -64.2 -42.6 96.56 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.096 174.606 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 66.8 mtt -92.32 -3.94 54.65 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.207 177.147 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 62.5 m80 65.86 14.41 9.55 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.876 -178.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.3 p . . . . . 0 C--O 1.251 1.147 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.612 -177.209 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 . . . . . 0 N--CA 1.48 1.055 0 CA-C-O 120.759 0.314 . . . . 0.0 110.316 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -113.51 110.33 20.1 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.895 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 34.3 m -108.5 0.67 9.7 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.024 -177.618 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 42.0 t -75.07 -25.94 58.98 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.098 -177.424 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -109.01 172.36 6.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.883 -175.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.512 ' O ' ' HB ' ' A' ' 24' ' ' ILE . 24.5 mm-40 -87.06 98.8 11.48 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 175.02 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.464 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 12.9 m120 -80.05 141.98 35.35 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.078 -174.223 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.457 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 44.1 t -80.4 109.41 12.66 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.497 175.251 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.528 ' HG2' ' HG2' ' A' ' 56' ' ' PRO . 92.5 Cg_endo -80.86 -4.92 12.96 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.454 2.103 . . . . 0.0 111.665 177.22 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.457 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 19.0 mm -72.96 -20.29 18.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.705 -178.843 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.717 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 21.2 p -163.61 17.69 0.07 Allowed 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.243 -179.283 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.452 HD12 ' N ' ' A' ' 21' ' ' LEU . 6.4 mp 49.08 80.0 0.07 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.164 0.506 . . . . 0.0 109.969 -174.052 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.717 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 0.5 OUTLIER -150.24 170.67 18.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.66 -173.078 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -82.93 137.49 34.19 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 122.889 0.475 . . . . 0.0 111.406 -177.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.512 ' HB ' ' O ' ' A' ' 15' ' ' GLN . 26.6 mt -136.72 131.32 47.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 109.641 -0.504 . . . . 0.0 109.641 171.469 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 66.7 m170 -117.37 178.73 4.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.588 178.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.9 t -65.46 -17.31 64.45 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -174.026 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 67.7 m -60.12 94.52 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.055 0.455 . . . . 0.0 111.562 -178.802 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.6 mtt85 -80.45 17.29 1.11 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.667 -178.427 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.6 t -88.94 -51.8 11.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.122 0.487 . . . . 0.0 109.705 173.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 57.6 t -84.32 -38.18 13.49 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.977 177.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.451 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -82.19 97.65 8.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.801 175.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.402 ' O ' HD12 ' A' ' 40' ' ' LEU . 9.3 t60 -61.11 136.48 58.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.912 -178.547 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.7 p -89.76 124.69 42.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.213 0.53 . . . . 0.0 111.222 -177.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.657 HD12 ' HB2' ' A' ' 38' ' ' HIS . 60.5 mt -76.27 151.85 83.65 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.408 174.515 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.5 -22.5 35.01 Favored 'Trans proline' 0 CA--C 1.535 0.531 0 C-N-CA 122.58 2.186 . . . . 0.0 112.295 175.118 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.2 t -95.46 12.8 28.1 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.853 -177.348 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 83.8 15.6 70.01 Favored Glycine 0 C--N 1.337 0.627 0 N-CA-C 114.5 0.56 . . . . 0.0 114.5 170.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.657 ' HB2' HD12 ' A' ' 34' ' ' LEU . 59.3 m-70 -100.01 156.62 17.06 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 117.555 0.678 . . . . 0.0 110.619 178.044 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.451 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 97.1 mt -112.66 142.5 45.19 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.674 176.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.537 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -159.27 140.79 13.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.784 175.006 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.513 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -54.18 155.42 3.68 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.648 0.261 . . . . 0.0 111.413 179.115 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.512 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 55.1 mmm-85 -36.35 -66.57 0.21 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.26 1.024 . . . . 0.0 113.284 -173.265 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 30.8 m -64.53 -36.58 84.65 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.762 0.315 . . . . 0.0 111.486 -172.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.513 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -64.14 -28.54 69.83 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.736 -178.942 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.537 ' HB2' HD13 ' A' ' 40' ' ' LEU . 32.3 t80 -58.49 -50.03 75.22 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.818 175.299 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -66.63 -41.61 88.04 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.232 -178.611 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.417 ' O ' ' HB3' ' A' ' 50' ' ' LYS . 19.2 mm-40 -56.58 -54.99 39.58 Favored 'General case' 0 C--O 1.235 0.335 0 O-C-N 123.332 0.395 . . . . 0.0 111.724 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 14.7 ttp -61.67 -49.67 75.57 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.141 0.496 . . . . 0.0 110.338 -178.024 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 32.0 tp -64.7 -28.61 69.72 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.539 -178.177 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.417 ' HB3' ' O ' ' A' ' 47' ' ' GLU . 34.7 ttpt -63.61 -47.85 79.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.405 177.357 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.402 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 51.4 mt-10 -75.4 -26.95 58.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.75 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 62.9 25.97 68.38 Favored Glycine 0 C--N 1.331 0.304 0 CA-C-N 115.956 -0.565 . . . . 0.0 113.27 175.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.402 ' HD1' ' HB2' ' A' ' 51' ' ' GLU . 20.0 p90 -83.71 176.12 9.19 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 178.588 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 32.3 mtp180 -70.3 130.6 42.42 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 -176.314 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 1.5 p -60.37 107.4 1.03 Allowed Pre-proline 0 CA--C 1.532 0.258 0 CA-C-O 120.663 0.268 . . . . 0.0 111.553 -178.542 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.528 ' HG2' ' HG2' ' A' ' 18' ' ' PRO . 39.5 Cg_endo -66.19 -18.21 55.7 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.757 2.304 . . . . 0.0 112.32 -175.399 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.589 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -69.88 -13.25 62.16 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 120.937 0.399 . . . . 0.0 110.182 179.247 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.8 OUTLIER -74.04 -22.8 59.41 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.319 173.262 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 27.3 ttt -83.5 -49.46 9.24 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 178.353 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 13.5 p-80 -171.22 162.27 6.86 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.466 171.825 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 52.0 p . . . . . 0 C--O 1.25 1.12 0 CA-C-O 118.393 -0.813 . . . . 0.0 109.828 179.432 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.864 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -78.26 92.59 4.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.477 0.656 . . . . 0.0 110.587 -179.182 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 17.2 m -98.15 108.82 22.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.822 175.362 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 62.7 m -70.38 80.63 0.55 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.408 0.623 . . . . 0.0 111.357 -176.497 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 80.0 mm-40 -111.22 153.51 25.74 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.012 173.548 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.434 ' HB2' ' O ' ' A' ' 24' ' ' ILE . 15.7 mm-40 -69.04 87.69 0.39 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.361 0.601 . . . . 0.0 110.183 -177.835 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 -90.12 141.41 28.71 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.624 -179.413 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.413 ' HB2' HG13 ' A' ' 24' ' ' ILE . 33.4 t -72.6 110.07 7.41 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.759 177.869 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.571 ' HG2' ' HG ' ' A' ' 57' ' ' LEU . 15.6 Cg_exo -67.62 -19.94 47.51 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.464 2.109 . . . . 0.0 111.373 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.453 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 10.4 mm -70.04 -18.39 21.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.387 -174.514 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.57 ' SG ' ' HG3' ' A' ' 22' ' ' GLU . 19.1 p -167.87 21.95 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 121.047 -0.261 . . . . 0.0 111.689 -178.331 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 89.3 mt 55.98 28.69 13.07 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.57 ' HG3' ' SG ' ' A' ' 20' ' ' CYS . 39.0 mt-10 -91.54 -177.73 4.89 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 177.072 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -91.94 151.56 20.46 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.889 0.376 . . . . 0.0 110.475 175.692 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.434 ' O ' ' HB2' ' A' ' 15' ' ' GLN . 15.2 mt -143.05 111.98 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 173.06 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 35.4 t60 -89.88 150.91 22.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.178 -177.403 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 12.9 m -53.36 -25.46 15.38 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.085 -177.254 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.8 p -64.74 89.47 0.07 Allowed 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.09 0.471 . . . . 0.0 110.367 177.3 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.2 ppt_? -78.22 18.96 0.47 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.997 -175.408 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.8 p -73.05 -30.95 33.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-O 121.206 0.527 . . . . 0.0 109.687 172.195 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.0 p -101.62 -38.55 6.01 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.436 177.339 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -82.6 111.11 18.28 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.51 179.726 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -64.82 133.52 52.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.117 -179.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.3 p -92.1 122.14 43.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.082 0.468 . . . . 0.0 111.131 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.594 HD12 ' HB2' ' A' ' 38' ' ' HIS . 82.7 mt -67.81 155.08 92.42 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.639 172.119 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.41 -12.82 35.02 Favored 'Trans proline' 0 CA--C 1.531 0.357 0 C-N-CA 122.102 1.868 . . . . 0.0 111.736 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 38.4 t -100.74 13.69 34.07 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.593 -179.613 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.19 17.34 65.03 Favored Glycine 0 C--N 1.336 0.578 0 N-CA-C 114.458 0.543 . . . . 0.0 114.458 169.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.604 ' HB3' HD22 ' A' ' 57' ' ' LEU . 41.9 m-70 -103.27 156.11 17.96 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 117.53 0.665 . . . . 0.0 110.421 177.426 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.5 mt -112.01 144.6 41.09 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.849 0.357 . . . . 0.0 111.252 -179.418 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.543 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -163.31 151.47 13.62 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.301 175.551 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.554 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -69.83 163.28 26.2 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.886 178.165 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.481 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 57.3 mmm-85 -48.53 -57.67 5.81 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 123.822 0.701 . . . . 0.0 112.183 -174.576 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 42.8 p -52.73 -57.04 11.4 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.423 0.63 . . . . 0.0 110.599 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.554 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.5 OUTLIER -58.15 -26.67 62.99 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.111 -0.95 . . . . 0.0 111.679 -179.971 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.543 ' HB2' HD13 ' A' ' 40' ' ' LEU . 39.6 t80 -66.71 -48.98 67.51 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 177.427 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -63.98 -43.57 95.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.455 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -57.2 -53.05 62.46 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.138 178.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.431 ' SD ' ' C ' ' A' ' 48' ' ' MET . 1.0 OUTLIER -65.61 -50.87 63.47 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.618 -177.063 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 42.8 tp -62.85 -30.28 71.38 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.715 -177.512 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 45.8 tttm -62.1 -51.48 67.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.127 0.489 . . . . 0.0 110.214 175.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.438 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 11.0 mm-40 -67.25 -35.44 79.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.641 -177.102 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 63.34 24.48 67.51 Favored Glycine 0 CA--C 1.519 0.32 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.937 176.809 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.438 ' HD1' ' HB2' ' A' ' 51' ' ' GLU . 14.8 p90 -79.77 163.4 24.49 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.58 ' H ' ' HD3' ' A' ' 54' ' ' ARG . 0.8 OUTLIER -61.07 130.33 45.8 Favored 'General case' 0 C--N 1.332 -0.152 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 -179.496 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.2 p -64.65 114.06 13.11 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.148 -174.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -67.96 -24.8 39.1 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.735 2.29 . . . . 0.0 111.879 -178.558 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.604 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -65.25 -15.79 62.86 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.62 -178.313 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.83 -21.59 66.82 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.871 0.367 . . . . 0.0 110.676 175.022 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.1 mpp? -110.44 14.23 22.61 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.425 175.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.424 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 57.1 t-80 -139.77 93.05 2.61 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 -178.378 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 34.9 m . . . . . 0 C--O 1.251 1.143 0 CA-C-O 118.856 -0.592 . . . . 0.0 109.778 -178.639 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 . . . . . 0 N--CA 1.479 1.009 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 50.9 m-80 -59.64 88.46 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.007 0.432 . . . . 0.0 111.296 -178.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 45.4 t -129.5 101.39 6.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 174.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.0 m -64.92 100.22 0.4 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.297 -176.213 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -157.8 133.85 9.38 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.76 179.295 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.42 ' OE1' ' HA ' ' A' ' 15' ' ' GLN . 14.4 mm-40 -92.65 97.63 10.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.189 0.519 . . . . 0.0 110.214 -179.486 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 -96.62 138.25 34.47 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.396 179.265 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.533 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 18.8 t -78.31 111.05 15.94 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.267 179.558 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -72.87 -12.98 26.55 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.214 1.943 . . . . 0.0 111.677 177.658 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.533 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 24.4 mm -71.35 -19.23 20.66 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.155 -178.07 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.6 p -168.31 20.5 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 120.962 -0.295 . . . . 0.0 111.775 -179.348 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.447 HD12 ' N ' ' A' ' 21' ' ' LEU . 6.3 mp 48.26 72.72 0.25 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.009 0.433 . . . . 0.0 110.716 -177.555 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -146.64 -176.62 5.26 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.379 -173.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -78.12 139.29 39.02 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.086 -176.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.457 HD13 ' O ' ' A' ' 39' ' ' LEU . 11.9 mt -145.43 140.31 22.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.288 169.901 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 22.8 m80 -145.46 173.47 11.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.635 0.255 . . . . 0.0 110.605 176.09 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 63.2 m -60.0 -24.64 64.62 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.802 -0.636 . . . . 0.0 112.691 -173.305 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -55.4 98.69 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.186 0.517 . . . . 0.0 110.853 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.49 -25.19 66.58 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.714 -174.693 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.471 HG13 HG23 ' A' ' 30' ' ' VAL . 13.6 p -58.27 -31.27 42.01 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-O 121.084 0.469 . . . . 0.0 110.162 179.231 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.471 HG23 HG13 ' A' ' 29' ' ' VAL . 73.0 t -96.61 -49.47 12.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.008 177.218 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.575 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -94.59 103.79 15.74 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.088 -177.929 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -66.56 139.37 57.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.855 178.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 52.4 t -87.19 120.85 37.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-O 120.735 0.302 . . . . 0.0 111.279 -178.383 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.583 HD12 ' HB2' ' A' ' 38' ' ' HIS . 55.2 mt -73.45 152.82 89.92 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.331 172.749 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -64.11 1.15 1.69 Allowed 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 123.241 2.627 . . . . 0.0 113.583 -178.51 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 47.7 t -115.7 4.26 14.03 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.781 0.325 . . . . 0.0 110.818 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.48 24.23 26.72 Favored Glycine 0 C--N 1.335 0.505 0 C-N-CA 121.219 -0.515 . . . . 0.0 113.987 173.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.583 ' HB2' HD12 ' A' ' 34' ' ' LEU . 69.1 m-70 -103.48 155.52 18.45 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 117.115 0.457 . . . . 0.0 110.669 174.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.575 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 88.8 mt -113.01 142.68 45.43 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.451 177.333 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.544 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -158.04 140.4 14.39 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.759 174.362 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.564 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -55.55 156.2 4.87 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.865 0.364 . . . . 0.0 111.096 -179.653 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.567 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 8.6 mmm180 -43.75 -59.81 2.07 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 114.857 -1.065 . . . . 0.0 113.098 -168.588 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 18.5 m -67.24 -37.65 83.9 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.605 0.241 . . . . 0.0 111.442 -174.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.564 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -62.19 -27.41 68.95 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.904 0.383 . . . . 0.0 110.289 179.243 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.567 ' HB3' ' O ' ' A' ' 42' ' ' ARG . 41.8 t80 -60.85 -47.45 86.32 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.103 175.681 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -60.85 -45.87 92.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.409 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.472 ' HA ' ' HE2' ' A' ' 50' ' ' LYS . 11.7 mm-40 -63.6 -40.02 95.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.849 -177.142 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.429 ' C ' ' SD ' ' A' ' 48' ' ' MET . 8.5 tmm? -72.64 -51.2 20.55 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.147 0.498 . . . . 0.0 109.708 179.826 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.8 tp -60.29 -27.69 67.49 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.617 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.472 ' HE2' ' HA ' ' A' ' 47' ' ' GLU . 17.3 ttmm -49.64 -38.73 33.49 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.226 177.018 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.8 mm-40 -93.73 -38.76 11.13 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.942 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 63.02 20.73 62.86 Favored Glycine 0 C--N 1.333 0.391 0 C-N-CA 121.14 -0.552 . . . . 0.0 112.418 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -71.14 -173.7 0.88 Allowed 'General case' 0 C--O 1.237 0.419 0 CA-C-O 120.88 0.371 . . . . 0.0 111.576 -178.567 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.49 136.32 58.01 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 175.442 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.447 ' HA ' ' HD2' ' A' ' 56' ' ' PRO . 0.8 OUTLIER -80.99 108.53 10.45 Favored Pre-proline 0 C--N 1.323 -0.562 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -172.253 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.447 ' HD2' ' HA ' ' A' ' 55' ' ' CYS . 27.5 Cg_endo -61.45 -20.95 70.52 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.468 2.112 . . . . 0.0 112.084 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.547 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -70.86 -12.08 61.33 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.724 -178.332 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -64.43 -12.99 48.96 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.234 0.54 . . . . 0.0 110.264 176.241 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.406 ' C ' ' SD ' ' A' ' 59' ' ' MET . 1.2 tmt? -80.75 -28.46 36.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.538 176.569 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -153.31 102.85 2.64 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.959 -176.105 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 73.9 m . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.608 -0.71 . . . . 0.0 109.912 176.129 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 . . . . . 0 N--CA 1.48 1.049 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.4 p-10 -90.87 140.14 30.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.911 0.386 . . . . 0.0 110.839 -178.241 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 35.2 t -77.63 79.45 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 177.362 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.1 p -104.89 106.48 16.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.922 -177.839 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -132.97 133.33 43.02 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.921 177.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.6 tp60 -69.91 145.94 51.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.126 0.489 . . . . 0.0 110.94 -178.659 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 28.8 p-10 -117.87 155.64 29.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.305 0.574 . . . . 0.0 110.482 177.554 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 17.4 t -90.8 109.69 36.44 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.225 176.102 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.51 ' HG2' ' HG ' ' A' ' 57' ' ' LEU . 20.6 Cg_exo -64.75 -25.72 60.83 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.387 2.058 . . . . 0.0 111.775 179.772 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.551 HD11 HD11 ' A' ' 57' ' ' LEU . 10.3 mm -62.81 -28.03 44.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 115.179 -0.919 . . . . 0.0 111.591 -173.565 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.1 p -155.59 12.1 0.33 Allowed 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 111.588 0.218 . . . . 0.0 111.588 -178.719 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 76.1 mt 52.37 79.56 0.11 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 122.838 0.455 . . . . 0.0 111.65 -177.289 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -144.32 167.6 22.06 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.227 -177.7 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -73.95 132.07 42.07 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.783 -177.078 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.9 mt -137.64 126.18 33.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 C-N-CA 122.927 0.491 . . . . 0.0 109.774 174.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 66.2 m170 -116.29 -172.46 2.18 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.941 0.401 . . . . 0.0 111.231 -178.188 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.9 t -61.24 -17.66 54.44 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.676 -176.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.3 t -59.8 99.51 0.07 Allowed 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.994 0.426 . . . . 0.0 111.101 -177.316 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.41 ' C ' ' HD2' ' A' ' 28' ' ' ARG . 0.7 OUTLIER -88.81 -1.92 58.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.435 178.2 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.3 p -89.95 -38.44 11.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.391 179.141 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 93.8 t -75.28 -54.94 12.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 175.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -86.85 137.37 32.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.161 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.9 t60 -73.96 134.1 43.09 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -179.579 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 9.0 p -96.14 121.89 47.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-O 121.267 0.556 . . . . 0.0 111.113 -178.051 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.602 HD12 ' HB2' ' A' ' 38' ' ' HIS . 86.1 mt -70.58 155.87 92.76 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.445 175.841 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -65.3 -15.73 51.32 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 122.341 2.027 . . . . 0.0 111.813 178.864 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 46.5 t -93.63 8.42 40.92 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.334 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 83.32 23.66 53.72 Favored Glycine 0 C--N 1.336 0.548 0 CA-C-N 116.006 -0.543 . . . . 0.0 114.056 172.376 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.677 ' HB3' HD22 ' A' ' 57' ' ' LEU . 44.9 m-70 -103.81 155.57 18.5 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 117.303 0.551 . . . . 0.0 110.271 175.805 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 61.3 mt -113.49 138.22 50.43 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.443 176.203 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.527 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -156.75 149.29 23.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.82 175.648 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.425 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -68.58 168.92 12.0 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.06 179.73 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.474 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 8.3 mmt180 -53.05 -60.73 2.92 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.651 -168.564 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 28.8 m -61.73 -43.8 98.16 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.992 0.425 . . . . 0.0 110.856 -178.063 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.425 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.5 OUTLIER -61.84 -26.47 68.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.2 -178.374 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.527 ' HB2' HD13 ' A' ' 40' ' ' LEU . 48.3 t80 -62.17 -49.51 75.55 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.214 0.53 . . . . 0.0 109.578 173.34 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -59.64 -46.56 88.62 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.188 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -56.63 -56.16 24.86 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.882 -175.833 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 15.4 ttp -64.96 -47.03 79.08 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.256 0.55 . . . . 0.0 110.47 -175.76 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 61.6 tp -66.42 -28.84 68.93 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.834 -177.029 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -65.21 -46.41 80.81 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.961 0.41 . . . . 0.0 110.586 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.474 ' HB2' ' CD1' ' A' ' 53' ' ' TYR . 14.1 mm-40 -65.52 -23.81 66.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.802 -177.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 63.18 43.13 99.07 Favored Glycine 0 C--N 1.331 0.27 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.832 176.029 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.474 ' CD1' ' HB2' ' A' ' 51' ' ' GLU . 3.3 p90 -118.16 161.34 20.02 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.505 ' CD ' ' H ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -55.75 137.48 49.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.269 0.557 . . . . 0.0 111.107 179.803 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -63.39 115.67 19.85 Favored Pre-proline 0 CA--C 1.535 0.387 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.671 -171.495 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.765 ' HA ' ' SD ' ' A' ' 59' ' ' MET . 41.2 Cg_endo -66.46 -12.4 35.57 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 122.895 2.397 . . . . 0.0 112.356 -179.431 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.677 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.4 mp -79.28 -8.23 58.9 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 110.295 -0.261 . . . . 0.0 110.295 178.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -73.79 -48.54 30.81 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.894 0.378 . . . . 0.0 110.247 176.492 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.765 ' SD ' ' HA ' ' A' ' 56' ' ' PRO . 1.4 pmm? -90.83 -17.43 26.59 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.374 177.775 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 19.1 t-80 64.49 121.11 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.969 176.392 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 68.3 m . . . . . 0 C--O 1.25 1.085 0 CA-C-O 119.004 -0.522 . . . . 0.0 109.807 174.815 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 39.6 p30 . . . . . 0 C--O 1.231 0.12 0 N-CA-C 109.649 -0.501 . . . . 0.0 109.649 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.451 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 26.2 t -93.18 108.48 33.23 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.375 175.615 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -72.94 -16.95 25.64 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.246 1.964 . . . . 0.0 111.422 177.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.476 HD11 HD11 ' A' ' 57' ' ' LEU . 16.8 mm -63.18 -23.31 32.96 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.972 -177.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.464 ' SG ' ' HG3' ' A' ' 22' ' ' GLU . 21.7 p -161.69 18.15 0.1 Allowed 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -179.023 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 89.1 mt 59.36 35.22 23.09 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 176.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.464 ' HG3' ' SG ' ' A' ' 20' ' ' CYS . 38.6 mt-10 -103.94 -175.89 2.93 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 175.683 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -80.52 162.62 24.25 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.643 178.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.588 HD11 ' HA ' ' A' ' 40' ' ' LEU . 0.3 OUTLIER -160.77 153.49 4.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 122.909 0.483 . . . . 0.0 110.008 176.435 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.435 ' CE1' ' HB3' ' A' ' 27' ' ' SER . 1.9 p80 -146.42 164.16 33.35 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.31 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.3 p -64.91 -24.18 67.45 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 -171.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.435 ' HB3' ' CE1' ' A' ' 25' ' ' HIS . 32.9 t -59.17 112.82 1.85 Allowed 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.037 0.446 . . . . 0.0 110.668 179.25 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.734 ' H ' ' HD3' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -100.38 16.61 23.9 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.542 -174.63 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.573 HG13 HG23 ' A' ' 30' ' ' VAL . 7.2 p -76.18 -35.59 28.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.155 0.502 . . . . 0.0 109.677 173.511 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.573 HG23 HG13 ' A' ' 29' ' ' VAL . 57.4 t -97.19 -46.88 12.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.072 176.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.11 123.22 26.61 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.437 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -73.67 138.69 44.9 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 21.7 t -89.15 119.89 36.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.793 -178.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.569 HD12 ' HB2' ' A' ' 38' ' ' HIS . 76.6 mt -68.91 152.16 96.92 Favored Pre-proline 0 C--N 1.328 -0.338 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 169.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -66.61 -8.85 22.29 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.286 1.99 . . . . 0.0 112.238 -177.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 42.7 t -100.11 9.97 42.0 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.327 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.52 8.84 63.66 Favored Glycine 0 C--N 1.338 0.679 0 N-CA-C 114.663 0.625 . . . . 0.0 114.663 169.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.582 ' HB3' HD22 ' A' ' 57' ' ' LEU . 62.7 m-70 -94.81 156.89 16.17 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 117.553 0.677 . . . . 0.0 111.079 -178.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.4 mt -113.28 143.06 45.06 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.18 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.588 ' HA ' HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -158.29 142.27 15.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.682 174.986 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.608 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -55.77 154.62 6.78 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.573 0.225 . . . . 0.0 110.602 175.693 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.447 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 15.5 mmt180 -47.8 -54.92 10.9 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.535 -170.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.43 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 92.5 m -56.27 -41.09 75.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.069 0.461 . . . . 0.0 111.121 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.608 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -70.5 -25.48 63.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.966 -177.588 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.512 ' HB2' HD13 ' A' ' 40' ' ' LEU . 45.5 t80 -62.2 -42.65 99.49 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 173.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.457 ' O ' ' HG3' ' A' ' 50' ' ' LYS . 36.7 mt-10 -65.56 -49.23 69.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.584 176.233 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.489 ' HA ' ' HD3' ' A' ' 50' ' ' LYS . 42.4 mt-10 -54.66 -48.19 72.64 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.334 -178.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.476 ' C ' ' SD ' ' A' ' 48' ' ' MET . 0.5 OUTLIER -68.33 -51.9 39.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.493 -177.658 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 53.3 tp -61.83 -28.52 69.54 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.923 -176.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.489 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 9.6 mtpm? -53.68 -50.07 66.62 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.152 0.501 . . . . 0.0 110.42 173.355 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.442 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 7.4 mm-40 -76.14 -44.46 38.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.031 -176.147 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 69.75 22.78 76.95 Favored Glycine 0 C--N 1.333 0.364 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.641 -176.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.442 ' HD1' ' HB2' ' A' ' 51' ' ' GLU . 5.7 p90 -75.67 170.81 15.45 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 122.732 0.413 . . . . 0.0 111.2 -175.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -60.72 124.68 21.14 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.932 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.6 p -65.22 110.13 3.87 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -176.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -67.52 -26.33 40.39 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.636 2.224 . . . . 0.0 112.088 -176.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.582 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -61.63 -17.63 56.1 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 120.871 0.367 . . . . 0.0 110.72 -177.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.47 0.532 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.214 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 . . . . . 0 C--O 1.233 0.215 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.46 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 27.2 t -72.48 109.34 5.76 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.606 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.65 -15.46 21.66 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.297 1.998 . . . . 0.0 111.353 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.46 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 26.7 mm -63.24 -23.47 33.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.204 -177.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 29.5 p -157.1 12.12 0.23 Allowed 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -179.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 88.2 mt 53.72 69.53 0.7 Allowed 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.326 0.584 . . . . 0.0 110.759 -175.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -146.09 146.06 30.77 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.188 -0.914 . . . . 0.0 108.856 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -67.58 162.57 23.16 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -176.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.7 tt -145.76 146.77 19.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.843 0.354 . . . . 0.0 110.583 -176.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -93.45 144.66 25.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.044 178.468 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 15.4 t -75.59 -18.32 59.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.889 0.376 . . . . 0.0 110.522 178.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.413 ' O ' HG12 ' A' ' 30' ' ' VAL . 9.0 t -63.5 117.67 7.07 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.092 178.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 67.6 ttt-85 -63.7 -31.27 72.39 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.508 -176.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.409 HG12 ' OG ' ' A' ' 27' ' ' SER . 12.4 p -60.83 -22.75 27.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -174.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.413 HG12 ' O ' ' A' ' 27' ' ' SER . 7.0 p -106.79 2.53 10.1 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-O 120.888 0.375 . . . . 0.0 111.702 -174.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -138.02 164.84 28.07 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.993 0.425 . . . . 0.0 111.068 -177.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 8.2 t60 -100.41 135.61 41.57 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 174.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 48.8 t -95.21 122.33 46.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.609 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.664 HD12 ' HB2' ' A' ' 38' ' ' HIS . 71.1 mt -72.09 153.2 92.68 Favored Pre-proline 0 C--N 1.325 -0.495 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 173.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -63.49 -17.31 59.45 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.577 2.184 . . . . 0.0 111.746 -178.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.4 t -93.5 7.96 42.55 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.504 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.51 23.7 46.06 Favored Glycine 0 C--N 1.337 0.634 0 CA-C-N 116.257 -0.429 . . . . 0.0 113.668 172.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.664 ' HB2' HD12 ' A' ' 34' ' ' LEU . 43.5 m-70 -103.5 156.99 17.35 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 122.595 -0.356 . . . . 0.0 111.175 178.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 44.4 mt -111.11 142.94 42.62 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.879 177.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.493 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -160.63 145.3 14.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.821 173.089 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.559 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -58.88 162.27 4.26 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.68 0.276 . . . . 0.0 110.687 176.478 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.491 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 24.4 mmt180 -50.4 -57.12 8.71 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.811 -169.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 24.8 p -59.44 -49.04 79.35 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.39 -177.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.559 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -59.22 -27.95 66.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.56 -176.456 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.493 ' HB2' HD13 ' A' ' 40' ' ' LEU . 31.5 t80 -55.3 -53.64 53.63 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.611 0.72 . . . . 0.0 109.783 174.435 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.493 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 6.4 mm-40 -69.66 -37.66 76.81 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.542 -1.208 . . . . 0.0 110.57 -177.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -62.56 -41.16 98.74 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.53 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 19.5 ttp -75.19 -50.39 16.38 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.026 0.441 . . . . 0.0 110.155 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 48.8 tp -61.55 -28.71 69.53 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.425 -177.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.493 ' HB2' ' O ' ' A' ' 46' ' ' GLU . 22.7 ttmm -57.96 -45.18 87.08 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.076 176.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.9 mm-40 -74.4 -40.81 61.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.158 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 65.19 46.22 88.45 Favored Glycine 0 N--CA 1.451 -0.317 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.374 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 20.8 p90 -104.49 -179.51 3.97 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -64.14 120.17 11.58 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.882 -177.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.6 p -54.59 108.24 1.09 Allowed Pre-proline 0 C--O 1.235 0.315 0 CA-C-O 120.77 0.319 . . . . 0.0 111.845 -178.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -65.16 -19.19 62.78 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 122.784 2.323 . . . . 0.0 112.422 -174.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.585 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -71.59 -11.27 60.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.989 0.423 . . . . 0.0 110.323 -179.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.466 0.341 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.901 173.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 120.891 0.377 . . . . 0.0 110.269 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.57 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 42.8 t -97.74 111.06 57.89 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.641 -177.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.424 ' HG2' ' HG ' ' A' ' 57' ' ' LEU . 72.0 Cg_endo -77.5 -12.34 16.94 Favored 'Trans proline' 0 CA--C 1.534 0.504 0 C-N-CA 122.259 1.973 . . . . 0.0 112.129 175.111 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.57 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 29.0 mm -59.85 -44.47 94.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-O 120.794 0.331 . . . . 0.0 110.808 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.562 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 27.8 p -132.0 15.72 4.7 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.539 -177.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 51.8 mt 52.41 72.28 0.41 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 121.28 0.562 . . . . 0.0 109.591 -175.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.562 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 21.1 tt0 -146.13 -176.45 5.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.311 -171.458 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.496 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 16.0 t70 -86.82 156.35 19.92 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 122.543 0.337 . . . . 0.0 111.308 178.725 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.559 HG13 ' HB2' ' A' ' 17' ' ' CYS . 8.5 mt -148.87 105.1 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 169.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -76.1 136.65 39.85 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.535 -0.542 . . . . 0.0 109.535 172.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.7 m -52.81 -17.69 1.5 Allowed 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -171.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.6 m -52.35 106.42 0.15 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 120.857 0.36 . . . . 0.0 111.338 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -62.61 -24.39 67.56 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.111 -178.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.7 t -53.54 -30.67 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-O 121.079 0.466 . . . . 0.0 110.955 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 60.6 t -106.26 -47.09 8.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.452 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.57 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -79.55 107.0 11.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.703 -178.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.597 ' HB2' HH11 ' A' ' 42' ' ' ARG . 9.4 t60 -69.1 134.99 50.08 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.211 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.2 t -87.15 115.2 27.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.249 -178.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.651 HD12 ' HB2' ' A' ' 38' ' ' HIS . 43.0 mt -72.01 147.82 91.37 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.99 170.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -55.61 -24.64 46.18 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.818 2.345 . . . . 0.0 112.498 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.9 t -88.72 5.92 41.06 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.761 -177.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.24 23.66 33.9 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 121.315 -0.469 . . . . 0.0 113.54 173.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.651 ' HB2' HD12 ' A' ' 34' ' ' LEU . 70.3 m-70 -102.89 155.61 18.23 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.9 0.35 . . . . 0.0 111.013 178.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.57 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 81.1 mt -115.71 136.93 52.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.343 175.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.584 HD21 HD11 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -160.26 146.36 15.44 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.747 0.308 . . . . 0.0 111.101 175.222 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.549 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -58.91 157.65 9.51 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.223 178.39 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.597 HH11 ' HB2' ' A' ' 32' ' ' HIS . 26.2 mmt180 -46.57 -58.37 3.87 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.567 -171.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.445 ' O ' ' HG2' ' A' ' 47' ' ' GLU . 28.4 m -57.65 -48.26 79.98 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.003 0.43 . . . . 0.0 110.93 -177.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.549 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -61.01 -28.74 69.26 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.921 -179.214 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.559 ' HB2' HD13 ' A' ' 40' ' ' LEU . 39.6 t80 -65.16 -55.29 19.49 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.501 177.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -61.5 -48.22 82.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.265 -175.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 43' ' ' THR . 48.6 mm-40 -59.69 -45.48 91.95 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -175.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 18.9 ttp -65.87 -44.99 83.73 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.029 0.442 . . . . 0.0 110.053 -179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 42.8 tp -68.89 -28.15 66.43 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.766 -179.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.443 ' HE2' ' HB3' ' A' ' 50' ' ' LYS . 4.7 tmmm? -68.45 -33.85 74.92 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.049 179.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -76.98 -56.23 4.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.593 173.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 91.0 14.68 57.44 Favored Glycine 0 C--N 1.332 0.314 0 CA-C-N 115.842 -0.617 . . . . 0.0 113.334 175.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 21.9 p90 -75.38 173.55 10.77 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 117.007 0.404 . . . . 0.0 110.333 177.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 -56.7 128.03 34.42 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.551 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.2 p -54.26 109.62 1.64 Allowed Pre-proline 0 C--O 1.235 0.306 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.546 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.459 ' HG2' HD13 ' A' ' 19' ' ' ILE . 23.9 Cg_endo -60.78 -25.93 82.06 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.729 2.286 . . . . 0.0 112.658 -175.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.571 HD22 ' HB3' ' A' ' 38' ' ' HIS . 3.9 mp -65.46 -15.68 62.88 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 120.902 0.382 . . . . 0.0 110.967 -177.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.465 0.288 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.581 176.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 34.8 p30 . . . . . 0 C--O 1.233 0.189 0 CA-C-O 121.021 0.439 . . . . 0.0 110.391 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.605 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 35.5 t -99.11 109.29 53.72 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.333 -177.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -74.24 -16.56 22.21 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.451 2.101 . . . . 0.0 111.557 175.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.605 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 34.4 mm -61.03 -25.89 37.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.022 -179.048 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 27.6 p -156.7 18.4 0.32 Allowed 'General case' 0 N--CA 1.466 0.349 0 O-C-N 122.41 -0.181 . . . . 0.0 111.335 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 80.2 mt 56.27 39.88 30.07 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.916 0.388 . . . . 0.0 111.507 177.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -118.29 174.33 6.29 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.183 -178.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -67.69 153.51 43.54 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.357 -175.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.514 HD11 ' HA ' ' A' ' 40' ' ' LEU . 1.8 mt -153.87 146.16 14.19 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 CA-C-N 115.287 -0.87 . . . . 0.0 108.986 171.435 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 24.0 m80 -149.25 -170.14 3.55 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 122.328 0.251 . . . . 0.0 110.564 178.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.487 ' O ' ' HD2' ' A' ' 28' ' ' ARG . 51.7 p -62.99 -17.55 62.26 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -173.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.5 m -57.54 99.45 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 111.536 0.199 . . . . 0.0 111.536 -178.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.52 ' HD2' ' H ' ' A' ' 28' ' ' ARG . 5.2 mpt_? -71.57 -28.73 64.04 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.191 0.52 . . . . 0.0 110.134 178.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 46.7 t -62.67 -38.14 80.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.079 177.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.538 ' O ' ' HA ' ' A' ' 41' ' ' HIS . 60.9 t -82.32 -62.62 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.85 -0.613 . . . . 0.0 109.658 176.398 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.527 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -85.69 98.72 10.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.491 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -61.98 143.45 56.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.34 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 40.2 t -86.89 115.58 27.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.363 -177.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.643 HD12 ' HB2' ' A' ' 38' ' ' HIS . 32.2 mt -67.39 151.79 96.81 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.812 173.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -59.15 -19.02 47.29 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.87 2.38 . . . . 0.0 111.896 174.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 32.5 t -99.51 18.17 18.55 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.501 -178.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.91 15.19 79.62 Favored Glycine 0 C--N 1.338 0.666 0 N-CA-C 114.706 0.642 . . . . 0.0 114.706 169.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.645 ' HB3' HD22 ' A' ' 57' ' ' LEU . 36.3 m-70 -103.0 157.39 17.01 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 117.58 0.69 . . . . 0.0 111.041 178.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.527 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 97.6 mt -108.57 138.54 44.71 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.849 177.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.537 HD21 HD11 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -158.91 138.9 12.04 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 122.83 0.452 . . . . 0.0 110.482 174.125 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.538 ' HA ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -56.46 163.5 1.72 Allowed 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.674 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.407 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 18.6 mmt180 -43.15 -64.72 0.58 Allowed 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 114.884 -1.053 . . . . 0.0 112.551 -173.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 24.3 p -56.56 -47.47 79.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.114 0.483 . . . . 0.0 110.923 -177.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.489 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.5 OUTLIER -61.98 -28.75 69.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.232 -179.671 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.522 ' HB2' HD13 ' A' ' 40' ' ' LEU . 53.5 t80 -68.63 -53.14 24.42 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.047 0.451 . . . . 0.0 110.034 176.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -62.28 -45.07 94.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.741 -177.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.1 mm-40 -59.85 -54.52 45.28 Favored 'General case' 0 C--O 1.234 0.261 0 O-C-N 123.129 0.268 . . . . 0.0 111.609 178.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.471 ' HA ' ' CE1' ' A' ' 53' ' ' TYR . 6.8 ttp -58.94 -40.79 85.72 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.131 0.491 . . . . 0.0 110.175 -176.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.1 tp -75.85 -29.91 58.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.875 -178.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 50.1 tttm -65.51 -51.11 62.34 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.257 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -71.24 -31.45 67.56 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.932 174.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 62.38 38.59 96.52 Favored Glycine 0 N--CA 1.452 -0.28 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.458 177.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.471 ' CE1' ' HA ' ' A' ' 48' ' ' MET . 41.1 p90 -88.12 -175.95 5.24 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.786 0.327 . . . . 0.0 110.634 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.847 ' H ' ' HD2' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -75.22 144.77 42.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.355 -173.951 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.5 p -84.27 107.09 9.69 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.805 -178.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -67.23 -13.52 39.82 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 122.516 2.144 . . . . 0.0 111.811 179.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.645 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -74.99 -6.75 51.02 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.44 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.465 0.303 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 173.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.454 -0.226 0 CA-C-O 121.024 0.44 . . . . 0.0 109.981 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.526 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 10.6 t -90.38 108.99 30.54 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.805 -176.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -68.96 -11.37 31.66 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.256 1.971 . . . . 0.0 112.041 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.526 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 26.5 mm -71.87 -21.1 20.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.875 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.417 ' SG ' ' CG ' ' A' ' 22' ' ' GLU . 21.8 p -164.12 17.49 0.06 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 120.944 -0.303 . . . . 0.0 111.776 -179.483 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.419 ' N ' ' O ' ' A' ' 17' ' ' CYS . 60.1 mt 53.67 31.08 12.06 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.417 ' CG ' ' SG ' ' A' ' 20' ' ' CYS . 56.4 mm-40 -101.97 -177.59 3.46 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.23 178.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -74.75 148.4 40.47 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -174.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.512 HD11 ' HA ' ' A' ' 40' ' ' LEU . 4.5 mt -149.72 124.0 1.68 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 C-N-CA 123.38 0.672 . . . . 0.0 109.924 170.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 18.1 t-80 -108.5 157.82 18.1 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 177.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.3 p -54.06 -22.48 10.87 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 9.6 m -61.94 100.51 0.16 Allowed 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.018 0.437 . . . . 0.0 110.555 177.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.9 ppt_? -81.18 16.81 1.43 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.532 -176.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 56.4 t -71.21 -47.63 59.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 172.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.419 ' O ' ' HA ' ' A' ' 41' ' ' HIS . 7.8 p -86.1 -38.4 12.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.199 175.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.511 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -86.76 101.86 13.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.67 -179.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -59.52 137.14 58.11 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.362 178.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 30.6 t -86.25 108.81 18.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.593 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.677 HD12 ' HB2' ' A' ' 38' ' ' HIS . 43.2 mt -66.9 151.04 97.4 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.286 173.519 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.4 -24.59 69.42 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.726 2.284 . . . . 0.0 112.237 179.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 43.0 t -91.13 7.73 39.15 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.65 -177.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.98 22.54 45.11 Favored Glycine 0 C--N 1.337 0.588 0 CA-C-N 116.103 -0.499 . . . . 0.0 113.872 172.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.677 ' HB2' HD12 ' A' ' 34' ' ' LEU . 78.0 m-70 -101.64 155.94 17.8 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 117.263 0.531 . . . . 0.0 110.784 177.07 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.511 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 71.0 mt -115.75 136.38 53.11 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.558 177.066 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.593 HD21 HD11 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -161.19 140.31 10.19 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.005 175.368 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.583 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -53.65 153.09 4.62 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.604 0.24 . . . . 0.0 111.518 179.354 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.477 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 15.3 mmt180 -44.24 -57.04 3.69 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.941 0.897 . . . . 0.0 112.203 -172.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.456 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 61.1 m -52.7 -49.35 65.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.04 -178.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.583 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -65.1 -30.87 71.85 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.029 -177.914 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.509 ' HB2' HD13 ' A' ' 40' ' ' LEU . 13.3 t80 -60.88 -50.31 73.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.98 175.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.471 ' O ' ' HG3' ' A' ' 50' ' ' LYS . 47.6 mt-10 -64.87 -41.43 95.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.592 -179.239 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 43' ' ' THR . 43.8 mt-10 -55.65 -55.36 33.05 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.998 0.428 . . . . 0.0 110.835 177.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 15.6 ttp -65.49 -40.92 93.63 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.918 -175.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 34.9 tp -73.84 -28.76 61.76 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.552 -173.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.471 ' HG3' ' O ' ' A' ' 46' ' ' GLU . 56.5 mttp -57.26 -47.73 80.68 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.104 0.478 . . . . 0.0 110.049 175.504 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -70.27 -39.18 75.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.61 173.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 64.63 19.76 65.3 Favored Glycine 0 N--CA 1.45 -0.416 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.257 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.2 p90 -70.75 173.94 6.62 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 120.761 0.315 . . . . 0.0 110.651 -177.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 67.9 mtt180 -65.04 122.9 18.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.532 -175.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.423 ' HA ' ' HD2' ' A' ' 56' ' ' PRO . 1.4 p -54.12 112.46 3.88 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.772 -173.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' ' 55' ' ' CYS . 34.3 Cg_endo -63.73 -24.86 68.68 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.73 2.287 . . . . 0.0 112.332 -178.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.57 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.6 mp -66.65 -14.42 62.44 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 120.762 0.315 . . . . 0.0 110.823 -178.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.467 0.375 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.976 174.113 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.1 p30 . . . . . 0 C--O 1.232 0.135 0 CA-C-O 121.226 0.536 . . . . 0.0 110.568 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.556 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 11.1 t -82.37 108.45 11.86 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.63 177.193 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.85 -11.52 29.53 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.171 1.914 . . . . 0.0 111.539 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.556 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 21.0 mm -69.5 -25.81 29.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.684 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.803 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 17.4 p -165.21 22.77 0.05 Allowed 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -177.025 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 90.9 mt 59.03 24.71 12.99 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 176.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.803 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 0.3 OUTLIER -97.33 171.21 8.56 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 -177.515 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -76.34 150.75 36.84 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.977 0.417 . . . . 0.0 111.239 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.467 HD13 ' O ' ' A' ' 39' ' ' LEU . 7.4 mt -144.12 121.9 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.261 172.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 -105.05 159.71 15.61 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.933 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.541 ' O ' ' HD3' ' A' ' 28' ' ' ARG . 0.9 OUTLIER -59.33 -17.5 29.99 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -177.714 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.3 m -59.63 104.89 0.31 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.631 -0.259 . . . . 0.0 111.687 -177.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.541 ' HD3' ' O ' ' A' ' 26' ' ' THR . 1.7 mpp_? -66.88 -14.61 62.93 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.776 0.322 . . . . 0.0 110.683 176.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 58.4 t -69.99 -33.22 54.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.554 176.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 59.2 t -98.24 -50.58 11.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.275 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.516 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -93.09 113.29 25.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.254 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -62.16 128.29 35.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.739 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.413 ' HA ' HD23 ' A' ' 39' ' ' LEU . 7.2 p -83.66 121.52 36.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.269 0.557 . . . . 0.0 111.337 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.62 HD12 ' HB2' ' A' ' 38' ' ' HIS . 94.9 mt -73.05 154.34 90.72 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.647 174.692 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -62.64 -9.99 17.96 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.779 2.319 . . . . 0.0 112.251 178.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.8 t -107.23 17.46 22.88 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.207 0.527 . . . . 0.0 109.847 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.56 -14.89 63.75 Favored Glycine 0 C--N 1.341 0.84 0 N-CA-C 114.966 0.746 . . . . 0.0 114.966 168.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.62 ' HB2' HD12 ' A' ' 34' ' ' LEU . 14.2 m-70 -81.78 156.7 24.8 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 117.572 0.686 . . . . 0.0 111.385 -173.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.516 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 97.5 mt -109.65 145.27 36.77 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.282 177.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.513 HD21 HD11 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -157.96 152.43 24.73 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 174.047 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.45 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -70.59 171.81 9.64 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.76 0.314 . . . . 0.0 111.379 -179.577 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.476 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 12.3 mmm180 -46.48 -67.25 0.3 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.775 -173.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 22.3 m -60.71 -43.86 97.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.06 0.457 . . . . 0.0 110.681 -175.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.45 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.6 OUTLIER -63.68 -23.94 67.58 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.586 -176.27 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.512 ' HB2' HD13 ' A' ' 40' ' ' LEU . 34.4 t80 -61.4 -50.3 73.42 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 173.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.412 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 49.0 mt-10 -67.67 -41.21 84.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.721 -179.126 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -56.62 -51.03 70.23 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.489 -177.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 13.6 ttp -70.18 -49.52 49.55 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.933 0.397 . . . . 0.0 110.656 -177.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.4 tp -62.2 -34.77 77.1 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.913 -176.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 46' ' ' GLU . 38.6 ttmt -55.06 -48.04 74.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.286 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -68.9 -43.9 74.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.208 177.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.78 18.89 79.42 Favored Glycine 0 CA--C 1.519 0.287 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.861 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.439 ' CE2' ' HD3' ' A' ' 56' ' ' PRO . 13.7 p90 -79.06 176.9 9.23 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 178.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 79.2 mtp180 -62.41 119.47 9.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.613 0.244 . . . . 0.0 110.353 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.487 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 0.5 OUTLIER -51.37 113.87 4.41 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.51 178.426 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.439 ' HD3' ' CE2' ' A' ' 53' ' ' TYR . 35.0 Cg_endo -63.78 -17.59 60.51 Favored 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 122.519 2.146 . . . . 0.0 111.534 -178.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.496 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.8 mp -75.92 -2.66 31.35 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.143 179.074 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.463 0.223 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 171.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.522 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 32.6 m-80 . . . . . 0 CA--C 1.519 -0.221 0 CA-C-O 120.932 0.396 . . . . 0.0 110.723 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.572 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 12.8 t -71.2 110.23 6.93 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.518 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.522 ' HD3' ' O ' ' A' ' 16' ' ' ASN . 5.0 Cg_exo -75.06 -13.44 21.28 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.547 2.164 . . . . 0.0 110.864 174.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.572 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 11.9 mm -66.0 -27.0 39.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.856 -176.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.444 ' SG ' ' OE2' ' A' ' 22' ' ' GLU . 18.3 p -165.15 20.41 0.05 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 111.672 0.249 . . . . 0.0 111.672 -178.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 90.8 mt 55.73 89.65 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.81 0.338 . . . . 0.0 111.186 -177.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.444 ' OE2' ' SG ' ' A' ' 20' ' ' CYS . 26.6 mt-10 -157.09 171.86 19.7 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.651 -179.571 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -83.3 145.62 28.99 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.996 175.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 34.2 mt -138.75 111.73 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.34 173.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -80.35 150.92 29.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.683 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 16.3 p -57.74 -17.87 17.96 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -177.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.4 m -66.3 97.21 0.39 Allowed 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.735 0.302 . . . . 0.0 110.934 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.652 ' H ' ' HD3' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -78.09 11.41 2.31 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.101 0.477 . . . . 0.0 111.344 -179.046 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 37.4 t -74.39 -45.36 46.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 172.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.6 p -87.58 -44.81 16.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.052 178.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.85 112.89 18.65 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.233 -0.439 . . . . 0.0 109.946 177.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.403 ' O ' HD12 ' A' ' 40' ' ' LEU . 19.2 t60 -61.08 131.02 49.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.298 -178.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.43 ' HA ' HD23 ' A' ' 39' ' ' LEU . 7.3 p -86.36 120.61 36.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.017 179.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.6 HD12 ' HB2' ' A' ' 38' ' ' HIS . 76.2 mt -74.86 153.37 86.96 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.074 173.26 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.5 -18.13 58.91 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.295 1.996 . . . . 0.0 111.674 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 37.0 t -90.76 9.03 31.67 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.328 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.18 19.21 57.79 Favored Glycine 0 C--N 1.338 0.666 0 CA-C-N 116.112 -0.495 . . . . 0.0 114.127 171.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.6 ' HB2' HD12 ' A' ' 34' ' ' LEU . 61.2 m-70 -104.18 157.15 17.32 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 117.4 0.6 . . . . 0.0 111.1 177.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' A' ' 33' ' ' VAL . 93.5 mt -113.52 143.93 43.7 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.358 175.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.558 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -159.18 148.02 18.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.477 175.615 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.561 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.1 OUTLIER -58.25 151.76 18.71 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.446 175.858 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.472 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 17.5 mmt85 -47.84 -57.44 5.64 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.842 0.714 . . . . 0.0 112.092 -170.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.441 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 20.2 m -53.63 -40.43 65.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.171 0.51 . . . . 0.0 111.387 -178.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.561 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -72.14 -25.35 61.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.999 -176.058 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.558 ' HB2' HD13 ' A' ' 40' ' ' LEU . 20.5 t80 -61.2 -46.64 89.62 Favored 'General case' 0 C--O 1.232 0.143 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 173.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.73 -51.0 71.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.288 176.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 43' ' ' THR . 42.4 mt-10 -54.65 -55.87 25.03 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.615 -177.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 10.1 ttp -63.35 -44.95 93.38 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.777 -175.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 64.9 tp -64.09 -34.02 77.09 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.649 -177.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.424 ' NZ ' ' HB3' ' A' ' 50' ' ' LYS . 8.8 mtpm? -67.86 -50.23 57.65 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.972 0.415 . . . . 0.0 110.658 176.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -63.61 -29.35 70.61 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.85 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 60.93 23.71 61.79 Favored Glycine 0 C--N 1.332 0.319 0 CA-C-N 115.829 -0.623 . . . . 0.0 113.328 174.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -85.8 169.21 13.58 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 110.333 -0.247 . . . . 0.0 110.333 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 38.0 mmt180 -58.1 127.22 30.99 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.709 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 1.2 p -60.79 106.33 0.76 Allowed Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.214 178.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -65.93 -18.08 56.75 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.714 2.276 . . . . 0.0 112.272 -174.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.573 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.7 mp -68.76 -17.3 64.02 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.153 178.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.7 OUTLIER . . . . . 0 N--CA 1.468 0.465 0 CA-C-O 120.991 0.425 . . . . 0.0 110.422 174.23 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.1 p30 . . . . . 0 C--O 1.233 0.197 0 CA-C-O 121.112 0.482 . . . . 0.0 109.865 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.453 ' HB2' HG13 ' A' ' 24' ' ' ILE . 33.3 t -85.98 111.09 35.67 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.793 -178.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.506 ' HG2' ' HG ' ' A' ' 57' ' ' LEU . 17.2 Cg_exo -64.91 -19.01 63.9 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.353 2.036 . . . . 0.0 111.398 179.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.473 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 11.7 mm -76.65 -12.41 14.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.812 -173.328 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.451 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 20.2 p -171.68 19.36 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 77.9 mt 60.08 16.35 5.86 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 176.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.451 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 27.6 mm-40 -97.0 173.28 7.36 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.564 0.221 . . . . 0.0 111.105 -177.016 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -69.83 153.52 43.2 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 116.172 -0.467 . . . . 0.0 112.087 -175.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.453 HG13 ' HB2' ' A' ' 17' ' ' CYS . 4.3 mt -150.32 131.53 4.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 123.558 0.743 . . . . 0.0 109.431 172.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 52.3 m80 -114.46 168.85 9.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.83 177.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 14.5 t -70.23 -17.2 63.13 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.656 -175.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.7 p -69.32 133.12 47.46 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.644 177.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.689 ' HD2' ' H ' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -97.74 11.14 38.17 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.383 -176.915 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 64.0 t -58.67 -50.05 80.49 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-O 120.954 0.407 . . . . 0.0 110.289 178.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 49.4 t -100.95 -32.77 3.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.073 177.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.597 ' HA ' ' HA ' ' A' ' 41' ' ' HIS . . . -86.72 104.54 16.21 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.285 -178.293 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.2 t60 -65.21 131.53 46.75 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.3 p -89.56 115.46 29.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.025 0.441 . . . . 0.0 110.743 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.632 HD12 ' HB2' ' A' ' 38' ' ' HIS . 86.6 mt -64.5 153.41 86.94 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.086 175.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -67.26 -10.59 29.15 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.27 1.98 . . . . 0.0 111.364 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 38.6 t -97.03 9.67 41.43 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.386 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.95 17.38 59.64 Favored Glycine 0 C--N 1.338 0.68 0 N-CA-C 114.33 0.492 . . . . 0.0 114.33 171.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.648 ' HB3' HD22 ' A' ' 57' ' ' LEU . 25.4 m-70 -103.84 156.08 18.11 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 117.499 0.649 . . . . 0.0 110.945 178.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 71.5 mt -112.9 135.92 53.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.946 0.403 . . . . 0.0 110.95 176.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.515 HD21 HD11 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -155.09 137.0 14.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.11 173.654 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 31' ' ' ALA . 0.0 OUTLIER -58.0 163.48 2.75 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.884 0.374 . . . . 0.0 111.934 -177.952 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.45 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 16.1 mmm180 -37.59 -69.01 0.13 Allowed 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 114.463 -1.244 . . . . 0.0 113.204 -174.301 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 53.3 m -63.22 -35.74 81.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.005 0.431 . . . . 0.0 111.292 -174.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.499 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -68.45 -24.05 64.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.175 -177.284 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.45 ' HB3' ' O ' ' A' ' 42' ' ' ARG . 30.1 t80 -60.82 -43.71 97.86 Favored 'General case' 0 C--O 1.232 0.179 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 173.191 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.454 ' HB3' ' HE2' ' A' ' 50' ' ' LYS . 41.6 mt-10 -64.43 -48.46 75.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.091 177.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.574 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 43.6 mt-10 -54.04 -57.01 12.65 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.501 -176.184 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 11.4 ttp -63.96 -47.72 79.31 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.064 0.459 . . . . 0.0 110.574 -175.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.0 tp -61.73 -38.16 86.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.284 -175.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.454 ' HE2' ' HB3' ' A' ' 46' ' ' GLU . 68.9 mttm -71.25 -35.37 71.4 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.57 0.224 . . . . 0.0 111.017 -179.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.574 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 8.1 mm-40 -59.52 -31.59 69.53 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.004 0.43 . . . . 0.0 110.487 178.053 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.59 -4.34 60.55 Favored Glycine 0 CA--C 1.518 0.261 0 CA-C-N 115.797 -0.638 . . . . 0.0 114.065 171.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -73.12 166.75 22.51 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 117.677 0.738 . . . . 0.0 110.723 179.2 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 63.3 mtm180 -65.44 135.62 55.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.246 -0.434 . . . . 0.0 109.89 177.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 0.9 OUTLIER -54.14 109.72 1.69 Allowed Pre-proline 0 C--N 1.327 -0.37 0 O-C-N 123.304 0.377 . . . . 0.0 112.01 -178.195 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -66.49 -17.62 53.56 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.64 2.226 . . . . 0.0 111.877 -178.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.648 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -70.82 -8.71 54.49 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.177 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.465 0.301 0 CA-C-O 121.292 0.568 . . . . 0.0 109.85 174.245 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 . . . . . 0 CA--C 1.52 -0.196 0 CA-C-O 120.945 0.403 . . . . 0.0 109.995 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.635 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 13.4 t -96.78 110.52 53.82 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.134 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -68.63 -20.82 40.22 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.188 1.925 . . . . 0.0 111.097 175.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.635 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 19.3 mm -63.67 -25.51 38.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.241 -177.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.48 ' SG ' ' CG ' ' A' ' 22' ' ' GLU . 18.7 p -166.42 25.41 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.709 0.29 . . . . 0.0 111.597 -179.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 61.1 mt 54.78 21.96 3.88 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 112.867 0.692 . . . . 0.0 112.867 176.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.48 ' CG ' ' SG ' ' A' ' 20' ' ' CYS . 35.5 mm-40 -93.17 162.58 13.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.732 0.301 . . . . 0.0 110.962 -178.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -62.94 151.67 38.78 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.801 -179.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.2 mt -148.6 124.13 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.41 173.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -105.07 172.03 7.01 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 110.083 -0.339 . . . . 0.0 110.083 175.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.4 m -71.32 -18.75 62.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.724 -174.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.484 ' OG ' HG12 ' A' ' 29' ' ' VAL . 20.6 t -58.23 106.81 0.41 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 120.961 0.41 . . . . 0.0 110.87 -179.45 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.5 8.21 17.27 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.212 -175.407 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.484 HG12 ' OG ' ' A' ' 27' ' ' SER . 14.6 p -81.94 -38.95 16.21 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-O 121.006 0.432 . . . . 0.0 109.836 174.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.4 p -94.22 -44.46 13.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.013 177.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -87.47 97.9 11.09 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 175.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 8.8 t60 -58.49 127.36 31.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.498 -176.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.1 p -81.97 114.31 22.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.134 0.493 . . . . 0.0 110.736 179.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.623 HD12 ' HB2' ' A' ' 38' ' ' HIS . 76.8 mt -65.17 152.8 90.79 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.147 174.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.44 -3.65 12.24 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.348 2.032 . . . . 0.0 111.287 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 36.1 t -105.49 10.11 33.32 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.278 178.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 87.57 16.01 60.89 Favored Glycine 0 C--N 1.339 0.706 0 N-CA-C 114.92 0.728 . . . . 0.0 114.92 170.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.624 ' HB3' HD22 ' A' ' 57' ' ' LEU . 43.8 m-70 -104.3 156.5 17.86 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 117.759 0.779 . . . . 0.0 110.84 177.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 95.4 mt -113.3 137.19 51.86 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 122.533 0.333 . . . . 0.0 110.717 177.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.523 HD21 HD11 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -156.24 141.05 17.1 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.251 174.326 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.535 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -55.72 159.34 3.08 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.915 0.388 . . . . 0.0 111.701 179.71 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.515 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 21.5 mmt85 -42.4 -66.07 0.4 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 114.856 -1.065 . . . . 0.0 112.999 -172.217 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 25.2 m -61.67 -37.91 85.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.913 0.387 . . . . 0.0 111.056 -174.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.535 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -66.72 -26.83 67.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.945 179.852 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.515 ' HB3' ' O ' ' A' ' 42' ' ' ARG . 38.2 t80 -63.7 -48.61 76.39 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 174.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -61.74 -43.78 98.19 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.171 179.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.556 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 79.2 mm-40 -57.93 -56.58 20.16 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.844 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 8.5 ttp -61.52 -44.56 96.84 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.097 0.475 . . . . 0.0 110.411 -175.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 49.2 tp -66.39 -32.02 73.15 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.297 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.3 ttpp -68.64 -42.91 77.33 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.56 177.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.556 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 30.2 mm-40 -65.58 -37.81 87.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.836 177.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 64.8 39.09 96.35 Favored Glycine 0 C--N 1.333 0.379 0 CA-C-N 115.589 -0.732 . . . . 0.0 113.132 176.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 6.3 p90 -106.62 177.46 4.85 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.645 0.259 . . . . 0.0 110.693 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 34.6 mmt180 -64.39 119.18 9.87 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.004 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.455 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 0.8 OUTLIER -55.63 107.83 1.0 Allowed Pre-proline 0 CA--C 1.532 0.26 0 O-C-N 123.333 0.396 . . . . 0.0 111.513 -179.169 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -63.8 -21.18 69.41 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 122.697 2.265 . . . . 0.0 111.829 -175.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.624 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -69.48 -11.3 60.71 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.434 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.466 0.335 0 CA-C-O 121.159 0.504 . . . . 0.0 110.211 176.353 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.7 p30 . . . . . 0 C--O 1.232 0.173 0 CA-C-O 120.924 0.392 . . . . 0.0 110.082 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.554 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 39.1 t -91.07 108.1 25.81 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.183 174.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -72.68 -12.55 26.76 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.206 1.937 . . . . 0.0 111.189 176.343 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.554 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 14.3 mm -71.34 -15.18 18.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.988 -178.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.427 ' SG ' ' CG ' ' A' ' 22' ' ' GLU . 18.0 p -173.55 22.49 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 179.413 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 88.1 mt 58.73 24.66 12.49 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 176.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.427 ' CG ' ' SG ' ' A' ' 20' ' ' CYS . 42.9 mm-40 -99.15 159.92 14.64 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.668 0.271 . . . . 0.0 111.43 -177.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.25 148.27 52.08 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.206 177.3 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.486 HD13 ' O ' ' A' ' 39' ' ' LEU . 7.4 mt -138.44 120.8 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-O 121.087 0.47 . . . . 0.0 110.558 174.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 23.2 m80 -99.18 175.22 5.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.983 174.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 49.3 p -75.29 -39.65 59.46 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -173.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 35.5 t -45.32 117.85 1.53 Allowed 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.459 0.474 . . . . 0.0 112.202 -173.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.48 ' HA ' ' O ' ' A' ' 31' ' ' ALA . 0.0 OUTLIER -60.51 -20.83 61.43 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.053 179.463 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.2 t -57.55 -47.92 84.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-O 120.988 0.423 . . . . 0.0 110.397 179.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.525 ' O ' ' HA ' ' A' ' 41' ' ' HIS . 60.0 t -91.32 -50.59 12.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.324 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.544 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -99.79 102.78 14.31 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.06 -177.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.6 t60 -66.45 138.65 57.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.755 176.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 8.6 p -90.73 122.32 41.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-O 121.293 0.568 . . . . 0.0 111.254 -178.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.64 HD12 ' HB2' ' A' ' 38' ' ' HIS . 70.1 mt -72.28 154.56 92.0 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.615 174.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -58.03 -24.18 64.31 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 122.621 2.214 . . . . 0.0 112.201 177.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 48.0 t -89.72 9.03 28.71 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.575 -178.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.74 22.43 53.3 Favored Glycine 0 C--N 1.337 0.594 0 C-N-CA 121.415 -0.422 . . . . 0.0 113.665 173.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.64 ' HB2' HD12 ' A' ' 34' ' ' LEU . 71.4 m-70 -101.37 157.26 16.93 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 122.449 -0.442 . . . . 0.0 110.95 177.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.544 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 95.1 mt -112.56 137.38 50.87 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.982 174.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.529 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -154.28 142.83 20.73 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 174.205 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.525 ' HA ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -62.94 159.86 16.03 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.778 0.323 . . . . 0.0 111.576 -179.88 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.532 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 24.9 mmm180 -37.39 -67.64 0.18 Allowed 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 114.772 -1.104 . . . . 0.0 113.378 -174.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 89.4 m -60.95 -42.46 98.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.929 0.395 . . . . 0.0 111.154 -175.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.5 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -63.28 -25.73 68.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.078 -177.514 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.532 ' HB3' ' O ' ' A' ' 42' ' ' ARG . 44.3 t80 -60.13 -47.02 87.66 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 174.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -67.23 -42.73 83.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.183 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -54.93 -55.28 32.4 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.291 -178.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 15.5 ttp -68.64 -48.09 64.94 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.72 -175.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 39.2 tp -64.82 -28.95 69.91 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.858 -176.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -62.67 -43.31 99.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.263 0.554 . . . . 0.0 110.107 177.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -75.61 -38.45 59.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.713 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 67.32 28.4 73.67 Favored Glycine 0 CA--C 1.519 0.314 0 CA-C-N 115.857 -0.611 . . . . 0.0 112.776 178.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 17.1 p90 -85.11 176.89 8.12 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.42 ' O ' ' HD3' ' A' ' 56' ' ' PRO . 19.7 ptp180 -59.17 136.29 57.91 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 -179.331 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.5 p -72.62 107.15 2.73 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-O 120.615 0.245 . . . . 0.0 111.57 -177.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.42 ' HD3' ' O ' ' A' ' 54' ' ' ARG . 48.7 Cg_endo -67.45 -18.47 49.36 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.585 2.19 . . . . 0.0 111.927 -176.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.575 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -69.78 -15.67 63.16 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.553 -179.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.466 0.359 0 CA-C-O 120.984 0.421 . . . . 0.0 110.197 176.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.4 p30 . . . . . 0 C--O 1.234 0.258 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.433 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 40.7 t -96.76 107.64 38.11 Favored Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 110.224 -0.287 . . . . 0.0 110.224 177.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.15 -16.01 28.61 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.165 1.91 . . . . 0.0 111.447 178.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.433 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 17.2 mm -64.01 -27.2 42.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.746 -179.189 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.435 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 23.3 p -157.57 16.96 0.26 Allowed 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.345 -178.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 88.9 mt 55.89 29.26 13.84 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.053 0.541 . . . . 0.0 112.351 178.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.435 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 35.2 mm-40 -105.98 174.88 5.69 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.152 0.501 . . . . 0.0 111.933 -178.141 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -71.84 148.51 46.12 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.099 -0.955 . . . . 0.0 112.48 -174.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.405 HD11 ' HA ' ' A' ' 40' ' ' LEU . 6.2 mt -149.19 149.1 15.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 123.695 0.798 . . . . 0.0 109.04 174.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 45.1 m-70 -120.93 150.1 41.61 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 110.0 -0.371 . . . . 0.0 110.0 179.04 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.6 m -63.52 -17.4 62.75 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.25 -0.432 . . . . 0.0 112.078 -174.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.4 m -66.21 111.4 3.43 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.931 0.396 . . . . 0.0 110.932 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.473 ' HG2' HD21 ' A' ' 39' ' ' LEU . 64.8 mtm180 -72.82 -9.4 58.63 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.291 -176.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.9 p -71.32 -32.5 47.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.234 178.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.4 p -94.13 -36.35 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 CA-C-O 120.764 0.316 . . . . 0.0 111.227 -177.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -101.69 144.25 30.63 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.579 -178.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -72.31 131.77 43.13 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.405 ' HA ' HD23 ' A' ' 39' ' ' LEU . 7.3 p -93.46 124.55 45.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.065 0.459 . . . . 0.0 111.662 -175.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.706 HD12 ' HB2' ' A' ' 38' ' ' HIS . 55.0 mt -81.23 152.84 71.37 Favored Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.624 173.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -71.59 -2.59 11.58 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.734 2.289 . . . . 0.0 112.096 -178.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 46.6 t -104.04 9.27 36.54 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.068 176.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.3 23.14 49.24 Favored Glycine 0 C--N 1.336 0.563 0 CA-C-N 116.073 -0.512 . . . . 0.0 113.445 172.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.706 ' HB2' HD12 ' A' ' 34' ' ' LEU . 50.9 m-70 -104.19 156.01 18.25 Favored 'General case' 0 C--N 1.328 -0.335 0 O-C-N 122.538 -0.39 . . . . 0.0 111.239 177.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.473 HD21 ' HG2' ' A' ' 28' ' ' ARG . 60.7 mt -117.35 141.13 48.69 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.318 174.476 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.581 HD21 HD11 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -157.48 146.57 19.84 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.303 175.225 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.467 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -60.15 159.69 9.31 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.814 0.34 . . . . 0.0 111.071 179.794 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.447 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 21.7 mmt180 -47.37 -55.54 8.67 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.072 -0.967 . . . . 0.0 112.684 -168.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.41 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 60.5 m -65.71 -48.08 73.2 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 120.742 0.306 . . . . 0.0 111.149 -177.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.467 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -56.39 -28.2 58.53 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.164 -178.202 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.541 ' HB2' HD13 ' A' ' 40' ' ' LEU . 60.5 t80 -59.32 -53.04 62.76 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.263 0.554 . . . . 0.0 109.935 174.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -65.1 -36.47 84.42 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.673 -176.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 43' ' ' THR . 42.0 mt-10 -61.82 -54.92 35.58 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.816 -179.144 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 25.6 ttp -64.32 -44.76 90.53 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.962 0.41 . . . . 0.0 110.284 -178.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 55.9 tp -63.69 -34.79 78.63 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.829 -178.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.8 ttpp -60.49 -46.53 89.78 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.098 0.475 . . . . 0.0 109.99 177.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -66.79 -35.1 79.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.079 177.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 62.2 33.78 87.02 Favored Glycine 0 C--N 1.333 0.402 0 CA-C-N 115.626 -0.716 . . . . 0.0 112.866 176.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -96.75 176.1 6.12 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.631 0.216 . . . . 0.0 110.452 179.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.8 mtm180 -58.28 123.11 14.95 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.904 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.4 p -53.91 108.28 1.08 Allowed Pre-proline 0 CA--C 1.533 0.299 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.804 -179.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.06 -16.85 57.23 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 122.89 2.393 . . . . 0.0 112.859 -174.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.58 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.8 mp -70.45 -16.82 62.97 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 121.054 0.454 . . . . 0.0 110.315 178.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.466 0.341 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.226 173.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.3 p30 . . . . . 0 C--O 1.234 0.267 0 CA-C-O 120.801 0.334 . . . . 0.0 110.475 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.5 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 18.2 t -87.08 110.03 29.82 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.077 171.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -74.85 -18.45 19.12 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.508 2.139 . . . . 0.0 110.896 176.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.5 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 15.9 mm -61.7 -25.56 37.29 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.377 -175.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.467 ' SG ' ' HG3' ' A' ' 22' ' ' GLU . 18.3 p -164.81 18.22 0.05 Allowed 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.266 -177.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 80.6 mt 49.91 83.68 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.21 0.529 . . . . 0.0 111.642 -175.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.467 ' HG3' ' SG ' ' A' ' 20' ' ' CYS . 35.3 mt-10 -144.95 155.7 43.56 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.811 176.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -71.91 141.31 49.51 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 123.693 0.621 . . . . 0.0 110.512 175.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 10.0 mt -136.32 136.47 48.98 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.604 176.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.487 ' HD2' ' HB2' ' A' ' 27' ' ' SER . 2.2 p-80 -113.88 145.33 41.62 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.138 177.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.8 m -59.28 -15.91 18.52 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -173.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.487 ' HB2' ' HD2' ' A' ' 25' ' ' HIS . 14.8 m -45.47 108.52 0.13 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.288 0.566 . . . . 0.0 111.049 177.778 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -69.63 -30.01 67.63 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.532 -165.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 45.8 t -76.28 -19.71 15.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.888 0.375 . . . . 0.0 111.211 -174.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 94.3 t -99.8 -46.62 12.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.09 -179.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.35 113.37 23.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.197 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -65.97 138.14 57.62 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.972 -178.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.3 p -93.8 131.53 40.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.271 0.558 . . . . 0.0 111.997 -176.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.676 HD12 ' HB2' ' A' ' 38' ' ' HIS . 60.4 mt -81.79 146.36 56.09 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.302 169.6 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -55.9 -20.85 30.98 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 122.591 2.194 . . . . 0.0 112.107 177.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.3 t -92.54 10.3 30.86 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.646 -177.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.59 17.91 59.4 Favored Glycine 0 C--N 1.337 0.61 0 N-CA-C 114.372 0.509 . . . . 0.0 114.372 170.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.676 ' HB2' HD12 ' A' ' 34' ' ' LEU . 47.3 m-70 -103.37 157.33 17.1 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 117.489 0.645 . . . . 0.0 110.671 177.673 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 91.6 mt -113.45 140.0 48.46 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.878 0.371 . . . . 0.0 110.881 177.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.512 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -152.33 159.18 43.5 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.733 176.476 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.459 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -71.95 168.83 17.17 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.65 0.262 . . . . 0.0 111.066 179.527 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 25.4 mmt180 -44.31 -62.26 1.23 Allowed 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.158 -0.928 . . . . 0.0 112.005 -174.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.6 m -64.77 -49.43 70.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.381 -175.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.459 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -56.47 -27.06 55.94 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.921 -0.581 . . . . 0.0 112.072 -176.003 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.512 ' HB2' HD13 ' A' ' 40' ' ' LEU . 42.4 t80 -58.18 -51.18 70.82 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.691 0.757 . . . . 0.0 109.64 173.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -71.81 -39.1 70.08 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.446 -1.252 . . . . 0.0 110.642 -176.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.48 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 42.5 mt-10 -57.7 -56.41 22.34 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.627 179.008 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 19.8 ttp -63.25 -45.11 93.07 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.127 -176.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 29.0 tp -66.45 -31.24 71.87 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.934 -176.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.3 ttpp -68.8 -48.27 64.04 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.121 178.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 6.2 mm-40 -64.76 -36.38 84.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.067 178.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.13 29.82 68.29 Favored Glycine 0 C--N 1.332 0.339 0 CA-C-N 115.604 -0.726 . . . . 0.0 113.626 173.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.431 ' CD1' ' HB2' ' A' ' 51' ' ' GLU . 39.0 p90 -89.18 169.81 11.14 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 117.045 0.423 . . . . 0.0 110.639 178.202 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 55.6 mtp180 -63.79 125.86 25.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.62 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -55.68 108.8 1.29 Allowed Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.838 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -65.61 -17.44 56.92 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 122.852 2.368 . . . . 0.0 112.389 -177.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.601 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -72.47 -8.43 55.03 Favored 'General case' 0 CA--C 1.528 0.112 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.545 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.466 0.363 0 CA-C-O 120.837 0.351 . . . . 0.0 110.563 177.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.406 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 33.4 p30 . . . . . 0 C--O 1.233 0.214 0 CA-C-O 121.522 0.677 . . . . 0.0 111.565 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 10.5 t -87.79 108.46 20.86 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.481 172.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.406 ' HD3' ' O ' ' A' ' 16' ' ' ASN . 22.4 Cg_exo -63.54 -28.89 70.39 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.407 2.071 . . . . 0.0 111.26 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 8.5 mm -57.14 -23.09 17.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.759 -173.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.4 p -158.08 14.76 0.21 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 120.702 0.287 . . . . 0.0 110.937 178.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 90.3 mt 45.9 67.55 0.73 Allowed 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.543 0.687 . . . . 0.0 111.618 -176.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -136.06 -177.92 4.91 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 114.986 -1.006 . . . . 0.0 109.971 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -77.54 151.93 34.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.882 0.372 . . . . 0.0 111.641 -177.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.474 HD11 ' HA ' ' A' ' 40' ' ' LEU . 2.9 mt -147.72 146.08 18.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.274 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.333 172.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.413 ' CG ' ' H ' ' A' ' 26' ' ' THR . 3.5 t-160 -127.69 -178.66 4.57 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.448 0.166 . . . . 0.0 110.762 -177.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.413 ' H ' ' CG ' ' A' ' 25' ' ' HIS . 6.3 m -72.61 -33.2 66.53 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -167.195 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.5 t -59.08 117.59 4.88 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 120.894 0.378 . . . . 0.0 112.002 -171.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.557 ' HG3' HD21 ' A' ' 39' ' ' LEU . 6.8 mpt_? -76.8 -6.9 54.18 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.897 176.511 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.5 t -87.17 -35.02 7.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.698 178.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.1 t -81.4 -55.26 8.39 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.883 176.447 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -94.66 125.38 39.27 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.697 177.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -67.89 133.03 48.44 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 -178.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.7 p -87.57 116.62 30.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-O 121.106 0.479 . . . . 0.0 111.008 179.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.567 HD12 ' HB2' ' A' ' 38' ' ' HIS . 73.3 mt -65.7 155.42 86.14 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.462 175.396 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.26 -14.76 25.73 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.791 2.327 . . . . 0.0 112.423 178.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 48.9 t -101.57 11.02 39.7 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.78 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 83.45 22.22 56.87 Favored Glycine 0 C--N 1.335 0.511 0 CA-C-N 116.224 -0.444 . . . . 0.0 114.153 171.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.626 ' HB3' HD22 ' A' ' 57' ' ' LEU . 48.7 m-70 -103.01 156.66 17.52 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 117.281 0.54 . . . . 0.0 110.909 177.406 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.557 HD21 ' HG3' ' A' ' 28' ' ' ARG . 80.4 mt -113.11 141.25 47.13 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.865 0.364 . . . . 0.0 110.79 177.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.545 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -157.85 150.15 22.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.949 175.263 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.49 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -64.64 165.33 10.42 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.703 0.287 . . . . 0.0 111.433 179.339 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.457 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 10.0 mmm180 -48.88 -66.26 0.43 Allowed 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.121 -0.945 . . . . 0.0 112.876 -171.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 48.1 m -58.06 -40.89 82.14 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.962 0.41 . . . . 0.0 110.842 -175.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.49 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.5 OUTLIER -65.94 -29.57 70.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.81 179.755 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.545 ' HB2' HD13 ' A' ' 40' ' ' LEU . 20.8 t80 -63.46 -55.6 22.88 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.394 178.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -59.24 -49.4 77.98 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.967 -175.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.428 ' HA ' ' HD3' ' A' ' 50' ' ' LYS . 7.3 mm-40 -57.19 -43.34 82.61 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.988 -178.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.436 ' C ' ' SD ' ' A' ' 48' ' ' MET . 0.7 OUTLIER -68.72 -44.48 73.79 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 121.069 0.462 . . . . 0.0 110.358 178.898 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.484 ' O ' HD13 ' A' ' 49' ' ' LEU . 2.3 tm? -66.2 -33.66 76.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.625 -174.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 46.6 mtpt -59.15 -34.36 71.99 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.968 178.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.421 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 42.6 mt-10 -96.15 -38.72 10.04 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.983 -177.438 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 65.12 26.95 71.77 Favored Glycine 0 CA--C 1.518 0.261 0 CA-C-N 115.99 -0.55 . . . . 0.0 112.375 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.421 ' HD1' ' HB2' ' A' ' 51' ' ' GLU . 33.7 p90 -70.71 177.92 3.32 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 122.425 0.29 . . . . 0.0 111.166 -177.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.427 ' O ' ' HD3' ' A' ' 56' ' ' PRO . 15.2 mmt180 -56.65 121.57 10.05 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.837 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.2 p -73.46 105.83 1.93 Allowed Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.413 -178.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.427 ' HD3' ' O ' ' A' ' 54' ' ' ARG . 46.4 Cg_endo -66.8 -13.79 41.28 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 122.58 2.187 . . . . 0.0 112.156 -176.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.626 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -73.54 -14.94 61.3 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.296 179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.478 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.459 177.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 39.9 p30 . . . . . 0 N--CA 1.464 0.237 0 CA-C-O 121.163 0.506 . . . . 0.0 111.108 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.465 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 44.8 t -108.79 108.16 60.57 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.593 172.377 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -74.01 -14.97 23.59 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.264 1.976 . . . . 0.0 111.469 177.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.465 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 23.3 mm -64.44 -24.13 34.96 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.046 -177.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.0 p -161.16 10.81 0.09 Allowed 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 -177.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 9.3 mp 54.76 94.12 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.314 0.578 . . . . 0.0 110.569 -172.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -160.02 164.35 33.28 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.859 -178.069 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -73.83 137.55 43.87 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.734 -179.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.2 mt -141.12 148.33 21.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 174.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -134.98 166.0 24.04 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.0 m -52.06 -17.03 0.89 Allowed 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 122.994 0.518 . . . . 0.0 112.05 177.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.3 m -48.73 86.79 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.328 0.651 . . . . 0.0 111.882 179.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 50.2 ttp180 -81.1 -4.95 56.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.894 -176.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 47.9 t -80.27 -36.84 16.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.267 0.556 . . . . 0.0 109.741 175.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.2 t -88.65 -54.41 7.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.531 177.37 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.94 117.83 18.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.123 -179.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 48.4 t60 -69.52 127.56 33.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.036 -179.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.9 p -88.45 118.6 34.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.245 0.545 . . . . 0.0 111.284 -177.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.586 HD12 ' HB2' ' A' ' 38' ' ' HIS . 92.7 mt -62.81 150.4 87.4 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.755 172.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -59.05 -12.76 16.52 Favored 'Trans proline' 0 CA--C 1.535 0.537 0 C-N-CA 122.712 2.275 . . . . 0.0 112.953 177.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.3 t -96.91 6.69 48.18 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.77 0.319 . . . . 0.0 110.801 178.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.14 19.99 47.94 Favored Glycine 0 C--N 1.337 0.632 0 N-CA-C 114.286 0.474 . . . . 0.0 114.286 172.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.607 ' HB3' HD22 ' A' ' 57' ' ' LEU . 39.9 m-70 -104.0 156.87 17.51 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 117.505 0.652 . . . . 0.0 110.981 178.01 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.6 mt -113.65 137.07 52.12 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.79 0.328 . . . . 0.0 111.189 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.578 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -157.24 157.5 34.41 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.859 174.661 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.492 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -72.31 166.65 22.04 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.174 -179.693 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.495 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 26.3 mmm180 -49.13 -64.02 0.93 Allowed 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -172.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.489 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 27.2 m -60.56 -41.56 94.82 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.572 0.225 . . . . 0.0 110.628 -175.432 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.492 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -62.34 -27.57 69.15 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 120.884 0.373 . . . . 0.0 110.479 178.535 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.578 ' HB2' HD13 ' A' ' 40' ' ' LEU . 25.0 t80 -70.74 -44.76 66.13 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.933 174.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.41 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 42.7 mt-10 -66.9 -27.9 67.87 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.677 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.489 ' HG3' ' O ' ' A' ' 43' ' ' THR . 43.9 mt-10 -73.21 -51.79 16.46 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.24 175.136 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.446 ' C ' ' SD ' ' A' ' 48' ' ' MET . 0.6 OUTLIER -62.32 -54.27 42.94 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.894 -176.776 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 65.6 tp -61.72 -28.44 69.42 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.095 -177.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.534 ' NZ ' ' HB2' ' A' ' 50' ' ' LYS . 4.6 ttmp? -61.49 -40.63 95.29 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.057 0.456 . . . . 0.0 110.579 178.475 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.423 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 19.8 mm-40 -88.25 -33.12 18.19 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.011 -178.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 61.64 29.95 73.41 Favored Glycine 0 C--N 1.334 0.466 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.307 -178.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.493 ' HB2' ' NH1' ' A' ' 54' ' ' ARG . 16.0 p90 -82.52 174.04 11.43 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 120.806 0.336 . . . . 0.0 111.154 -175.351 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.493 ' NH1' ' HB2' ' A' ' 53' ' ' TYR . 0.3 OUTLIER -57.44 138.79 54.62 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.747 177.939 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.403 ' HA ' ' HD2' ' A' ' 56' ' ' PRO . 0.9 OUTLIER -90.37 107.17 18.08 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -175.353 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 55' ' ' CYS . 33.5 Cg_endo -63.63 -15.0 46.07 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.781 2.321 . . . . 0.0 112.192 179.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.607 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.9 mp -75.38 -6.64 51.01 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.418 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.466 0.337 0 CA-C-O 121.014 0.435 . . . . 0.0 109.869 173.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.401 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 8.4 p30 . . . . . 0 N--CA 1.457 -0.121 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.51 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 22.1 t -82.92 108.78 13.54 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.365 177.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.41 ' HG3' ' HG ' ' A' ' 57' ' ' LEU . 73.3 Cg_endo -74.89 -7.42 19.23 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.269 1.979 . . . . 0.0 111.437 179.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.51 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 21.3 mm -72.3 -22.98 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.41 178.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.679 ' SG ' ' HG3' ' A' ' 22' ' ' GLU . 21.3 p -163.09 22.62 0.09 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 120.726 0.298 . . . . 0.0 111.574 -179.528 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.406 ' N ' HD12 ' A' ' 21' ' ' LEU . 7.1 mp 57.32 25.93 11.79 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 174.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.679 ' HG3' ' SG ' ' A' ' 20' ' ' CYS . 54.0 mt-10 -93.28 -179.42 5.06 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 120.712 0.291 . . . . 0.0 110.62 178.257 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -90.39 149.53 22.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.406 177.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.4 mt -137.08 137.19 46.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 175.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 18.3 t60 -111.82 156.47 21.93 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 -177.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.5 t -56.7 -16.96 7.3 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -177.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.0 t -61.65 93.88 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.137 0.494 . . . . 0.0 110.839 -178.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 50.0 ttp180 -76.61 -14.32 60.0 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.625 -178.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.8 p -68.57 -19.03 23.87 Favored 'Isoleucine or valine' 0 C--O 1.238 0.447 0 CA-C-O 121.473 0.654 . . . . 0.0 109.495 173.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 61.2 t -99.09 -63.14 1.72 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.533 173.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.77 123.05 21.77 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.21 -178.017 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -76.17 140.31 41.67 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.804 178.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.404 ' HA ' ' O ' ' A' ' 38' ' ' HIS . 7.5 p -98.05 120.13 46.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-O 121.183 0.516 . . . . 0.0 111.308 -179.421 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.628 HD12 ' HB2' ' A' ' 38' ' ' HIS . 84.6 mt -61.27 148.65 84.88 Favored Pre-proline 0 C--O 1.233 0.215 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.022 172.742 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -56.8 -19.68 32.27 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.595 2.197 . . . . 0.0 112.45 179.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 46.7 t -88.98 0.35 56.73 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.975 -178.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.35 19.33 28.24 Favored Glycine 0 C--N 1.335 0.502 0 C-N-CA 121.41 -0.424 . . . . 0.0 114.084 174.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.628 ' HB2' HD12 ' A' ' 34' ' ' LEU . 54.6 m-70 -103.32 156.62 17.6 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 117.424 0.612 . . . . 0.0 111.241 179.412 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.0 mt -112.98 139.8 48.33 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 120.848 0.356 . . . . 0.0 111.445 178.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.563 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -162.86 149.04 12.37 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.579 176.178 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.563 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -58.9 158.43 8.33 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.042 175.547 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.528 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 9.9 mmt85 -50.91 -58.24 6.5 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 115.729 -0.668 . . . . 0.0 112.241 -170.316 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.444 ' O ' ' HG2' ' A' ' 47' ' ' GLU . 26.6 m -55.84 -44.25 77.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.238 -177.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.563 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -62.44 -31.9 72.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.764 179.267 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.563 ' HB2' HD13 ' A' ' 40' ' ' LEU . 34.5 t80 -62.34 -47.67 83.19 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.845 175.554 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -62.35 -51.47 67.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.56 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 43' ' ' THR . 23.0 mm-40 -62.84 -37.18 85.78 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.583 -177.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.453 ' C ' ' SD ' ' A' ' 48' ' ' MET . 0.5 OUTLIER -67.89 -51.36 48.93 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.255 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.4 tp -66.64 -28.42 68.46 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.589 -179.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -57.5 -50.62 72.47 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.371 177.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.418 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 28.5 mm-40 -79.92 -32.73 40.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.46 178.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 61.8 32.86 83.29 Favored Glycine 0 C--N 1.331 0.276 0 CA-C-N 115.91 -0.587 . . . . 0.0 112.46 179.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.418 ' HD1' ' HB2' ' A' ' 51' ' ' GLU . 22.8 p90 -77.66 -175.93 4.1 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.858 0.361 . . . . 0.0 110.727 -179.365 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.528 ' H ' ' HD2' ' A' ' 54' ' ' ARG . 2.4 mpt_? -72.73 122.37 21.39 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -177.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.4 p -61.8 107.3 1.07 Allowed Pre-proline 0 C--N 1.329 -0.323 0 O-C-N 123.102 0.251 . . . . 0.0 111.273 -178.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -59.84 -28.9 88.26 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.748 2.299 . . . . 0.0 112.163 -173.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.574 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.6 mp -62.61 -16.81 58.42 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.952 0.406 . . . . 0.0 110.85 -177.161 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.466 0.328 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.617 176.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.836 0.35 . . . . 0.0 110.354 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.458 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 43.5 t -92.27 108.19 28.95 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.704 176.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.433 ' HG2' ' HG2' ' A' ' 56' ' ' PRO . 73.6 Cg_endo -76.52 -8.67 18.43 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.246 1.964 . . . . 0.0 111.617 177.135 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.458 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 20.6 mm -70.91 -23.12 23.43 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.943 -177.58 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.471 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 21.4 p -162.18 12.63 0.08 Allowed 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -177.391 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 7.5 mp 54.97 91.02 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.215 0.531 . . . . 0.0 109.92 -171.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.471 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 0.4 OUTLIER -155.37 167.48 30.24 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.361 -174.134 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -88.92 143.32 26.95 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.708 0.29 . . . . 0.0 110.401 179.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.4 mt -142.48 142.24 27.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -123.74 177.6 5.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.276 179.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 15.2 t -75.81 -15.82 60.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.593 -173.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.5 m -57.52 89.91 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 120.927 0.394 . . . . 0.0 111.224 179.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.505 ' HG2' HD21 ' A' ' 39' ' ' LEU . 82.8 mtt85 -71.81 -11.48 60.83 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.055 -177.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 66.6 t -66.74 -35.31 74.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.232 0.539 . . . . 0.0 109.994 173.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 40.0 t -94.08 -53.69 8.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.951 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -84.54 116.8 23.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.061 178.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -65.38 124.82 23.26 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.273 -177.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.492 ' HA ' HD23 ' A' ' 39' ' ' LEU . 7.3 p -80.73 116.94 25.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.099 0.476 . . . . 0.0 110.95 178.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.621 HD12 ' HB2' ' A' ' 38' ' ' HIS . 76.2 mt -65.98 154.91 88.42 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.046 174.149 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -67.99 -5.55 14.91 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.323 2.015 . . . . 0.0 111.475 178.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 30.2 t -106.03 14.49 27.76 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.402 178.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.66 2.53 75.69 Favored Glycine 0 C--N 1.341 0.846 0 N-CA-C 114.948 0.739 . . . . 0.0 114.948 169.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.621 ' HB2' HD12 ' A' ' 34' ' ' LEU . 25.9 m-70 -96.95 156.83 16.18 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 117.525 0.662 . . . . 0.0 111.339 -175.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.505 HD21 ' HG2' ' A' ' 28' ' ' ARG . 98.1 mt -114.0 142.57 46.0 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.876 178.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.528 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -157.04 152.12 26.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.862 175.872 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.512 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -66.15 167.82 9.48 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.991 178.761 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.509 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 15.4 mmm180 -50.17 -60.45 2.95 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.174 -169.233 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 28.3 m -66.22 -41.43 90.09 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.247 -175.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.512 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -60.8 -26.38 67.25 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 120.77 0.319 . . . . 0.0 110.694 -178.941 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.528 ' HB2' HD13 ' A' ' 40' ' ' LEU . 39.5 t80 -59.67 -48.84 80.1 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.008 174.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -65.82 -44.31 85.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.629 -179.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -57.8 -51.69 68.52 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.925 -178.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 9.5 tmm? -65.0 -49.39 70.43 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.19 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 54.1 tp -62.12 -31.1 71.53 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.103 -177.266 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.4 ttmm -63.58 -40.44 96.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.918 0.389 . . . . 0.0 110.272 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -75.62 -41.4 54.41 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.363 176.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.87 45.92 94.32 Favored Glycine 0 C--N 1.333 0.388 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 -176.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -102.91 -175.71 2.89 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.784 0.325 . . . . 0.0 110.513 -175.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.454 ' HG3' ' O ' ' A' ' 54' ' ' ARG . 34.8 ptt180 -56.78 110.6 0.83 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.296 177.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.422 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 0.8 OUTLIER -64.81 105.48 0.74 Allowed Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.731 -0.213 . . . . 0.0 110.646 178.936 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.433 ' HG2' ' HG2' ' A' ' 18' ' ' PRO . 22.3 Cg_endo -59.49 -22.51 66.66 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 122.806 2.337 . . . . 0.0 112.408 -172.493 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.561 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.3 mp -66.93 -20.55 65.92 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.518 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.7 OUTLIER . . . . . 0 N--CA 1.466 0.372 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.096 174.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.464 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 12.9 m120 . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.904 0.383 . . . . 0.0 111.078 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.457 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 44.1 t -80.4 109.41 12.66 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.497 175.251 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.528 ' HG2' ' HG2' ' A' ' 56' ' ' PRO . 92.5 Cg_endo -80.86 -4.92 12.96 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.454 2.103 . . . . 0.0 111.665 177.22 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.457 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 19.0 mm -72.96 -20.29 18.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.705 -178.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.717 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 21.2 p -163.61 17.69 0.07 Allowed 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.243 -179.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.452 ' N ' HD12 ' A' ' 21' ' ' LEU . 6.4 mp 49.08 80.0 0.07 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.164 0.506 . . . . 0.0 109.969 -174.052 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.717 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 0.5 OUTLIER -150.24 170.67 18.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.66 -173.078 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -82.93 137.49 34.19 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 122.889 0.475 . . . . 0.0 111.406 -177.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 26.6 mt -136.72 131.32 47.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 109.641 -0.504 . . . . 0.0 109.641 171.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 66.7 m170 -117.37 178.73 4.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.588 178.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.9 t -65.46 -17.31 64.45 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -174.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 67.7 m -60.12 94.52 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.055 0.455 . . . . 0.0 111.562 -178.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.6 mtt85 -80.45 17.29 1.11 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.667 -178.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.6 t -88.94 -51.8 11.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.122 0.487 . . . . 0.0 109.705 173.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 57.6 t -84.32 -38.18 13.49 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.977 177.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.451 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -82.19 97.65 8.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.801 175.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.402 ' O ' HD12 ' A' ' 40' ' ' LEU . 9.3 t60 -61.11 136.48 58.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.912 -178.547 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.7 p -89.76 124.69 42.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.213 0.53 . . . . 0.0 111.222 -177.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.657 HD12 ' HB2' ' A' ' 38' ' ' HIS . 60.5 mt -76.27 151.85 83.65 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.408 174.515 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.5 -22.5 35.01 Favored 'Trans proline' 0 CA--C 1.535 0.531 0 C-N-CA 122.58 2.186 . . . . 0.0 112.295 175.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.2 t -95.46 12.8 28.1 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.853 -177.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 83.8 15.6 70.01 Favored Glycine 0 C--N 1.337 0.627 0 N-CA-C 114.5 0.56 . . . . 0.0 114.5 170.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.657 ' HB2' HD12 ' A' ' 34' ' ' LEU . 59.3 m-70 -100.01 156.62 17.06 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 117.555 0.678 . . . . 0.0 110.619 178.044 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.451 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 97.1 mt -112.66 142.5 45.19 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.674 176.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.537 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -159.27 140.79 13.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.784 175.006 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.513 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -54.18 155.42 3.68 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.648 0.261 . . . . 0.0 111.413 179.115 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.512 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 55.1 mmm-85 -36.35 -66.57 0.21 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.26 1.024 . . . . 0.0 113.284 -173.265 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 30.8 m -64.53 -36.58 84.65 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.762 0.315 . . . . 0.0 111.486 -172.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.513 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -64.14 -28.54 69.83 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.736 -178.942 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.537 ' HB2' HD13 ' A' ' 40' ' ' LEU . 32.3 t80 -58.49 -50.03 75.22 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.818 175.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -66.63 -41.61 88.04 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.232 -178.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.417 ' O ' ' HB3' ' A' ' 50' ' ' LYS . 19.2 mm-40 -56.58 -54.99 39.58 Favored 'General case' 0 C--O 1.235 0.335 0 O-C-N 123.332 0.395 . . . . 0.0 111.724 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 14.7 ttp -61.67 -49.67 75.57 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.141 0.496 . . . . 0.0 110.338 -178.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 32.0 tp -64.7 -28.61 69.72 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.539 -178.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.417 ' HB3' ' O ' ' A' ' 47' ' ' GLU . 34.7 ttpt -63.61 -47.85 79.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.405 177.357 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.402 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 51.4 mt-10 -75.4 -26.95 58.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.75 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 62.9 25.97 68.38 Favored Glycine 0 C--N 1.331 0.304 0 CA-C-N 115.956 -0.565 . . . . 0.0 113.27 175.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.402 ' HD1' ' HB2' ' A' ' 51' ' ' GLU . 20.0 p90 -83.71 176.12 9.19 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 178.588 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 32.3 mtp180 -70.3 130.6 42.42 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 -176.314 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 1.5 p -60.37 107.4 1.03 Allowed Pre-proline 0 CA--C 1.532 0.258 0 CA-C-O 120.663 0.268 . . . . 0.0 111.553 -178.542 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.528 ' HG2' ' HG2' ' A' ' 18' ' ' PRO . 39.5 Cg_endo -66.19 -18.21 55.7 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.757 2.304 . . . . 0.0 112.32 -175.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.589 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -69.88 -13.25 62.16 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 120.937 0.399 . . . . 0.0 110.182 179.247 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.465 0.314 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.319 173.262 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 . . . . . 0 N--CA 1.456 -0.132 0 CA-C-O 121.159 0.504 . . . . 0.0 110.624 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.413 ' HB2' HG13 ' A' ' 24' ' ' ILE . 33.4 t -72.6 110.07 7.41 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.759 177.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.571 ' HG2' ' HG ' ' A' ' 57' ' ' LEU . 15.6 Cg_exo -67.62 -19.94 47.51 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.464 2.109 . . . . 0.0 111.373 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.453 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 10.4 mm -70.04 -18.39 21.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.387 -174.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.57 ' SG ' ' HG3' ' A' ' 22' ' ' GLU . 19.1 p -167.87 21.95 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 121.047 -0.261 . . . . 0.0 111.689 -178.331 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 89.3 mt 55.98 28.69 13.07 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.57 ' HG3' ' SG ' ' A' ' 20' ' ' CYS . 39.0 mt-10 -91.54 -177.73 4.89 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 177.072 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -91.94 151.56 20.46 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.889 0.376 . . . . 0.0 110.475 175.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.413 HG13 ' HB2' ' A' ' 17' ' ' CYS . 15.2 mt -143.05 111.98 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 173.06 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 35.4 t60 -89.88 150.91 22.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.178 -177.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 12.9 m -53.36 -25.46 15.38 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.085 -177.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.8 p -64.74 89.47 0.07 Allowed 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.09 0.471 . . . . 0.0 110.367 177.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.2 ppt_? -78.22 18.96 0.47 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.997 -175.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.8 p -73.05 -30.95 33.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-O 121.206 0.527 . . . . 0.0 109.687 172.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.0 p -101.62 -38.55 6.01 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.436 177.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -82.6 111.11 18.28 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.51 179.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -64.82 133.52 52.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.117 -179.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.3 p -92.1 122.14 43.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.082 0.468 . . . . 0.0 111.131 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.594 HD12 ' HB2' ' A' ' 38' ' ' HIS . 82.7 mt -67.81 155.08 92.42 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.639 172.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.41 -12.82 35.02 Favored 'Trans proline' 0 CA--C 1.531 0.357 0 C-N-CA 122.102 1.868 . . . . 0.0 111.736 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 38.4 t -100.74 13.69 34.07 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.593 -179.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.19 17.34 65.03 Favored Glycine 0 C--N 1.336 0.578 0 N-CA-C 114.458 0.543 . . . . 0.0 114.458 169.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.604 ' HB3' HD22 ' A' ' 57' ' ' LEU . 41.9 m-70 -103.27 156.11 17.96 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 117.53 0.665 . . . . 0.0 110.421 177.426 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.5 mt -112.01 144.6 41.09 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.849 0.357 . . . . 0.0 111.252 -179.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.543 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -163.31 151.47 13.62 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.301 175.551 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.554 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -69.83 163.28 26.2 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.886 178.165 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.481 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 57.3 mmm-85 -48.53 -57.67 5.81 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 123.822 0.701 . . . . 0.0 112.183 -174.576 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 42.8 p -52.73 -57.04 11.4 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.423 0.63 . . . . 0.0 110.599 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.554 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.5 OUTLIER -58.15 -26.67 62.99 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.111 -0.95 . . . . 0.0 111.679 -179.971 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.543 ' HB2' HD13 ' A' ' 40' ' ' LEU . 39.6 t80 -66.71 -48.98 67.51 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 177.427 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -63.98 -43.57 95.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.455 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -57.2 -53.05 62.46 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.138 178.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.431 ' C ' ' SD ' ' A' ' 48' ' ' MET . 1.0 OUTLIER -65.61 -50.87 63.47 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.618 -177.063 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 42.8 tp -62.85 -30.28 71.38 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.715 -177.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 45.8 tttm -62.1 -51.48 67.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.127 0.489 . . . . 0.0 110.214 175.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.438 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 11.0 mm-40 -67.25 -35.44 79.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.641 -177.102 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 63.34 24.48 67.51 Favored Glycine 0 CA--C 1.519 0.32 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.937 176.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.438 ' HD1' ' HB2' ' A' ' 51' ' ' GLU . 14.8 p90 -79.77 163.4 24.49 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.58 ' H ' ' HD3' ' A' ' 54' ' ' ARG . 0.8 OUTLIER -61.07 130.33 45.8 Favored 'General case' 0 C--N 1.332 -0.152 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 -179.496 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.2 p -64.65 114.06 13.11 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.148 -174.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -67.96 -24.8 39.1 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.735 2.29 . . . . 0.0 111.879 -178.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.604 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -65.25 -15.79 62.86 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.62 -178.313 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.467 0.388 0 CA-C-O 120.871 0.367 . . . . 0.0 110.676 175.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 . . . . . 0 N--CA 1.455 -0.209 0 CA-C-O 121.204 0.526 . . . . 0.0 110.396 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.533 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 18.8 t -78.31 111.05 15.94 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.267 179.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -72.87 -12.98 26.55 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.214 1.943 . . . . 0.0 111.677 177.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.533 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 24.4 mm -71.35 -19.23 20.66 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.155 -178.07 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.6 p -168.31 20.5 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 120.962 -0.295 . . . . 0.0 111.775 -179.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.447 HD12 ' N ' ' A' ' 21' ' ' LEU . 6.3 mp 48.26 72.72 0.25 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.009 0.433 . . . . 0.0 110.716 -177.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -146.64 -176.62 5.26 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.379 -173.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -78.12 139.29 39.02 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.086 -176.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.457 HD13 ' O ' ' A' ' 39' ' ' LEU . 11.9 mt -145.43 140.31 22.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.288 169.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 22.8 m80 -145.46 173.47 11.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.635 0.255 . . . . 0.0 110.605 176.09 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 63.2 m -60.0 -24.64 64.62 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.802 -0.636 . . . . 0.0 112.691 -173.305 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -55.4 98.69 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.186 0.517 . . . . 0.0 110.853 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.49 -25.19 66.58 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.714 -174.693 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.471 HG13 HG23 ' A' ' 30' ' ' VAL . 13.6 p -58.27 -31.27 42.01 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-O 121.084 0.469 . . . . 0.0 110.162 179.231 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.471 HG23 HG13 ' A' ' 29' ' ' VAL . 73.0 t -96.61 -49.47 12.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.008 177.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.575 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -94.59 103.79 15.74 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.088 -177.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -66.56 139.37 57.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.855 178.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 52.4 t -87.19 120.85 37.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-O 120.735 0.302 . . . . 0.0 111.279 -178.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.583 HD12 ' HB2' ' A' ' 38' ' ' HIS . 55.2 mt -73.45 152.82 89.92 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.331 172.749 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -64.11 1.15 1.69 Allowed 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 123.241 2.627 . . . . 0.0 113.583 -178.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 47.7 t -115.7 4.26 14.03 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.781 0.325 . . . . 0.0 110.818 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.48 24.23 26.72 Favored Glycine 0 C--N 1.335 0.505 0 C-N-CA 121.219 -0.515 . . . . 0.0 113.987 173.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.583 ' HB2' HD12 ' A' ' 34' ' ' LEU . 69.1 m-70 -103.48 155.52 18.45 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 117.115 0.457 . . . . 0.0 110.669 174.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.575 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 88.8 mt -113.01 142.68 45.43 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.451 177.333 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.544 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -158.04 140.4 14.39 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.759 174.362 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.564 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -55.55 156.2 4.87 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.865 0.364 . . . . 0.0 111.096 -179.653 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.567 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 8.6 mmm180 -43.75 -59.81 2.07 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 114.857 -1.065 . . . . 0.0 113.098 -168.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 18.5 m -67.24 -37.65 83.9 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.605 0.241 . . . . 0.0 111.442 -174.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.564 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -62.19 -27.41 68.95 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.904 0.383 . . . . 0.0 110.289 179.243 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.567 ' HB3' ' O ' ' A' ' 42' ' ' ARG . 41.8 t80 -60.85 -47.45 86.32 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.103 175.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -60.85 -45.87 92.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.409 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.472 ' HA ' ' HE2' ' A' ' 50' ' ' LYS . 11.7 mm-40 -63.6 -40.02 95.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.849 -177.142 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.429 ' C ' ' SD ' ' A' ' 48' ' ' MET . 8.5 tmm? -72.64 -51.2 20.55 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.147 0.498 . . . . 0.0 109.708 179.826 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.8 tp -60.29 -27.69 67.49 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.617 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.472 ' HE2' ' HA ' ' A' ' 47' ' ' GLU . 17.3 ttmm -49.64 -38.73 33.49 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.226 177.018 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.8 mm-40 -93.73 -38.76 11.13 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.942 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 63.02 20.73 62.86 Favored Glycine 0 C--N 1.333 0.391 0 C-N-CA 121.14 -0.552 . . . . 0.0 112.418 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -71.14 -173.7 0.88 Allowed 'General case' 0 C--O 1.237 0.419 0 CA-C-O 120.88 0.371 . . . . 0.0 111.576 -178.567 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.49 136.32 58.01 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 175.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.447 ' HA ' ' HD2' ' A' ' 56' ' ' PRO . 0.8 OUTLIER -80.99 108.53 10.45 Favored Pre-proline 0 C--N 1.323 -0.562 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -172.253 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.447 ' HD2' ' HA ' ' A' ' 55' ' ' CYS . 27.5 Cg_endo -61.45 -20.95 70.52 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.468 2.112 . . . . 0.0 112.084 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.547 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -70.86 -12.08 61.33 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.724 -178.332 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.469 0.498 0 CA-C-O 121.234 0.54 . . . . 0.0 110.264 176.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 28.8 p-10 . . . . . 0 C--O 1.234 0.275 0 CA-C-O 121.305 0.574 . . . . 0.0 110.482 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 17.4 t -90.8 109.69 36.44 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.225 176.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.51 ' HG2' ' HG ' ' A' ' 57' ' ' LEU . 20.6 Cg_exo -64.75 -25.72 60.83 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.387 2.058 . . . . 0.0 111.775 179.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.551 HD11 HD11 ' A' ' 57' ' ' LEU . 10.3 mm -62.81 -28.03 44.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 115.179 -0.919 . . . . 0.0 111.591 -173.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.1 p -155.59 12.1 0.33 Allowed 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 111.588 0.218 . . . . 0.0 111.588 -178.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 76.1 mt 52.37 79.56 0.11 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 122.838 0.455 . . . . 0.0 111.65 -177.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -144.32 167.6 22.06 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.227 -177.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -73.95 132.07 42.07 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.783 -177.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.9 mt -137.64 126.18 33.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 C-N-CA 122.927 0.491 . . . . 0.0 109.774 174.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 66.2 m170 -116.29 -172.46 2.18 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.941 0.401 . . . . 0.0 111.231 -178.188 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.9 t -61.24 -17.66 54.44 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.676 -176.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.3 t -59.8 99.51 0.07 Allowed 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.994 0.426 . . . . 0.0 111.101 -177.316 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.41 ' HD2' ' C ' ' A' ' 28' ' ' ARG . 0.7 OUTLIER -88.81 -1.92 58.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.435 178.2 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.3 p -89.95 -38.44 11.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.391 179.141 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 93.8 t -75.28 -54.94 12.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 175.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -86.85 137.37 32.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.161 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.9 t60 -73.96 134.1 43.09 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -179.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 9.0 p -96.14 121.89 47.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-O 121.267 0.556 . . . . 0.0 111.113 -178.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.602 HD12 ' HB2' ' A' ' 38' ' ' HIS . 86.1 mt -70.58 155.87 92.76 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.445 175.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -65.3 -15.73 51.32 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 122.341 2.027 . . . . 0.0 111.813 178.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 46.5 t -93.63 8.42 40.92 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.334 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 83.32 23.66 53.72 Favored Glycine 0 C--N 1.336 0.548 0 CA-C-N 116.006 -0.543 . . . . 0.0 114.056 172.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.677 ' HB3' HD22 ' A' ' 57' ' ' LEU . 44.9 m-70 -103.81 155.57 18.5 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 117.303 0.551 . . . . 0.0 110.271 175.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 61.3 mt -113.49 138.22 50.43 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.443 176.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.527 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -156.75 149.29 23.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.82 175.648 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.425 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -68.58 168.92 12.0 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.06 179.73 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.474 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 8.3 mmt180 -53.05 -60.73 2.92 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.651 -168.564 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 28.8 m -61.73 -43.8 98.16 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.992 0.425 . . . . 0.0 110.856 -178.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.425 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.5 OUTLIER -61.84 -26.47 68.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.2 -178.374 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.527 ' HB2' HD13 ' A' ' 40' ' ' LEU . 48.3 t80 -62.17 -49.51 75.55 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.214 0.53 . . . . 0.0 109.578 173.34 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -59.64 -46.56 88.62 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.188 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -56.63 -56.16 24.86 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.882 -175.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 15.4 ttp -64.96 -47.03 79.08 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.256 0.55 . . . . 0.0 110.47 -175.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 61.6 tp -66.42 -28.84 68.93 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.834 -177.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -65.21 -46.41 80.81 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.961 0.41 . . . . 0.0 110.586 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.474 ' HB2' ' CD1' ' A' ' 53' ' ' TYR . 14.1 mm-40 -65.52 -23.81 66.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.802 -177.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 63.18 43.13 99.07 Favored Glycine 0 C--N 1.331 0.27 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.832 176.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.474 ' CD1' ' HB2' ' A' ' 51' ' ' GLU . 3.3 p90 -118.16 161.34 20.02 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.505 ' CD ' ' H ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -55.75 137.48 49.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.269 0.557 . . . . 0.0 111.107 179.803 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -63.39 115.67 19.85 Favored Pre-proline 0 CA--C 1.535 0.387 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.671 -171.495 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -66.46 -12.4 35.57 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 122.895 2.397 . . . . 0.0 112.356 -179.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.677 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.4 mp -79.28 -8.23 58.9 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 110.295 -0.261 . . . . 0.0 110.295 178.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.468 0.446 0 CA-C-O 120.894 0.378 . . . . 0.0 110.247 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 . . . . . 0 N--CA 1.479 0.98 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -74.48 84.67 2.01 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.033 0.444 . . . . 0.0 110.375 -177.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 34.1 m -94.35 -15.15 7.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.728 179.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 70.0 m -69.32 -16.69 63.6 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.028 178.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -108.29 118.44 36.78 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 176.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.2 mm-40 -76.99 162.45 27.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.86 -169.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 39.6 p30 -139.61 162.69 34.49 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.649 178.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.451 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 26.2 t -93.18 108.48 33.23 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.375 175.615 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -72.94 -16.95 25.64 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.246 1.964 . . . . 0.0 111.422 177.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.476 HD11 HD11 ' A' ' 57' ' ' LEU . 16.8 mm -63.18 -23.31 32.96 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.972 -177.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.464 ' SG ' ' HG3' ' A' ' 22' ' ' GLU . 21.7 p -161.69 18.15 0.1 Allowed 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -179.023 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 89.1 mt 59.36 35.22 23.09 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 176.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.464 ' HG3' ' SG ' ' A' ' 20' ' ' CYS . 38.6 mt-10 -103.94 -175.89 2.93 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 175.683 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -80.52 162.62 24.25 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.643 178.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.588 HD11 ' HA ' ' A' ' 40' ' ' LEU . 0.3 OUTLIER -160.77 153.49 4.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 122.909 0.483 . . . . 0.0 110.008 176.435 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.435 ' CE1' ' HB3' ' A' ' 27' ' ' SER . 1.9 p80 -146.42 164.16 33.35 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.31 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.3 p -64.91 -24.18 67.45 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 -171.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.435 ' HB3' ' CE1' ' A' ' 25' ' ' HIS . 32.9 t -59.17 112.82 1.85 Allowed 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.037 0.446 . . . . 0.0 110.668 179.25 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.734 ' H ' ' HD3' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -100.38 16.61 23.9 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.542 -174.63 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.573 HG13 HG23 ' A' ' 30' ' ' VAL . 7.2 p -76.18 -35.59 28.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.155 0.502 . . . . 0.0 109.677 173.511 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.573 HG23 HG13 ' A' ' 29' ' ' VAL . 57.4 t -97.19 -46.88 12.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.072 176.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.11 123.22 26.61 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.437 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -73.67 138.69 44.9 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 21.7 t -89.15 119.89 36.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.793 -178.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.569 HD12 ' HB2' ' A' ' 38' ' ' HIS . 76.6 mt -68.91 152.16 96.92 Favored Pre-proline 0 C--N 1.328 -0.338 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 169.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -66.61 -8.85 22.29 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.286 1.99 . . . . 0.0 112.238 -177.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 42.7 t -100.11 9.97 42.0 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.327 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.52 8.84 63.66 Favored Glycine 0 C--N 1.338 0.679 0 N-CA-C 114.663 0.625 . . . . 0.0 114.663 169.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.582 ' HB3' HD22 ' A' ' 57' ' ' LEU . 62.7 m-70 -94.81 156.89 16.17 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 117.553 0.677 . . . . 0.0 111.079 -178.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.4 mt -113.28 143.06 45.06 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.18 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.588 ' HA ' HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -158.29 142.27 15.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.682 174.986 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.608 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -55.77 154.62 6.78 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.573 0.225 . . . . 0.0 110.602 175.693 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.447 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 15.5 mmt180 -47.8 -54.92 10.9 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.535 -170.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.43 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 92.5 m -56.27 -41.09 75.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.069 0.461 . . . . 0.0 111.121 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.608 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -70.5 -25.48 63.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.966 -177.588 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.512 ' HB2' HD13 ' A' ' 40' ' ' LEU . 45.5 t80 -62.2 -42.65 99.49 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 173.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.457 ' O ' ' HG3' ' A' ' 50' ' ' LYS . 36.7 mt-10 -65.56 -49.23 69.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.584 176.233 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.489 ' HA ' ' HD3' ' A' ' 50' ' ' LYS . 42.4 mt-10 -54.66 -48.19 72.64 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.334 -178.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.476 ' C ' ' SD ' ' A' ' 48' ' ' MET . 0.5 OUTLIER -68.33 -51.9 39.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.493 -177.658 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 53.3 tp -61.83 -28.52 69.54 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.923 -176.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.489 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 9.6 mtpm? -53.68 -50.07 66.62 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.152 0.501 . . . . 0.0 110.42 173.355 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.442 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 7.4 mm-40 -76.14 -44.46 38.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.031 -176.147 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 69.75 22.78 76.95 Favored Glycine 0 C--N 1.333 0.364 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.641 -176.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.442 ' HD1' ' HB2' ' A' ' 51' ' ' GLU . 5.7 p90 -75.67 170.81 15.45 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 122.732 0.413 . . . . 0.0 111.2 -175.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -60.72 124.68 21.14 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.932 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.6 p -65.22 110.13 3.87 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -176.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.582 ' O ' ' HG2' ' A' ' 59' ' ' MET . 48.6 Cg_endo -67.52 -26.33 40.39 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.636 2.224 . . . . 0.0 112.088 -176.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.582 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -61.63 -17.63 56.1 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 120.871 0.367 . . . . 0.0 110.72 -177.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -62.97 -12.32 24.82 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.214 178.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.582 ' HG2' ' O ' ' A' ' 56' ' ' PRO . 26.8 ptm -89.99 -16.41 29.9 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.608 0.242 . . . . 0.0 111.329 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -125.51 127.61 46.7 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 -175.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.2 p . . . . . 0 C--O 1.25 1.117 0 CA-C-O 118.936 -0.554 . . . . 0.0 109.928 -179.297 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.501 ' HG2' ' ND2' ' A' ' 11' ' ' ASN . 36.6 tt0 . . . . . 0 N--CA 1.479 0.984 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.501 ' ND2' ' HG2' ' A' ' 10' ' ' GLU . 55.7 m-80 60.53 91.76 0.05 Allowed 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.172 0.51 . . . . 0.0 110.843 -177.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 26.9 m -113.66 34.19 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.035 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.2 m -68.47 83.53 0.27 Allowed 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.609 -174.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 49.1 tp60 -165.86 93.83 0.56 Allowed 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 175.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -76.93 165.74 24.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.254 -173.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -127.77 139.21 52.81 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 176.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.46 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 27.2 t -72.48 109.34 5.76 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.606 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.65 -15.46 21.66 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.297 1.998 . . . . 0.0 111.353 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.46 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 26.7 mm -63.24 -23.47 33.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.204 -177.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 29.5 p -157.1 12.12 0.23 Allowed 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -179.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 88.2 mt 53.72 69.53 0.7 Allowed 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.326 0.584 . . . . 0.0 110.759 -175.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -146.09 146.06 30.77 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.188 -0.914 . . . . 0.0 108.856 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -67.58 162.57 23.16 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -176.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.7 tt -145.76 146.77 19.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.843 0.354 . . . . 0.0 110.583 -176.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -93.45 144.66 25.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.044 178.468 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 15.4 t -75.59 -18.32 59.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.889 0.376 . . . . 0.0 110.522 178.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.413 ' O ' HG12 ' A' ' 30' ' ' VAL . 9.0 t -63.5 117.67 7.07 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.092 178.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 67.6 ttt-85 -63.7 -31.27 72.39 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.508 -176.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.409 HG12 ' OG ' ' A' ' 27' ' ' SER . 12.4 p -60.83 -22.75 27.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -174.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.413 HG12 ' O ' ' A' ' 27' ' ' SER . 7.0 p -106.79 2.53 10.1 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-O 120.888 0.375 . . . . 0.0 111.702 -174.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -138.02 164.84 28.07 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.993 0.425 . . . . 0.0 111.068 -177.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 8.2 t60 -100.41 135.61 41.57 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 174.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 48.8 t -95.21 122.33 46.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.609 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.664 HD12 ' HB2' ' A' ' 38' ' ' HIS . 71.1 mt -72.09 153.2 92.68 Favored Pre-proline 0 C--N 1.325 -0.495 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 173.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -63.49 -17.31 59.45 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.577 2.184 . . . . 0.0 111.746 -178.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.4 t -93.5 7.96 42.55 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.504 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.51 23.7 46.06 Favored Glycine 0 C--N 1.337 0.634 0 CA-C-N 116.257 -0.429 . . . . 0.0 113.668 172.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.664 ' HB2' HD12 ' A' ' 34' ' ' LEU . 43.5 m-70 -103.5 156.99 17.35 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 122.595 -0.356 . . . . 0.0 111.175 178.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 44.4 mt -111.11 142.94 42.62 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.879 177.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.493 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -160.63 145.3 14.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.821 173.089 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.559 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -58.88 162.27 4.26 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.68 0.276 . . . . 0.0 110.687 176.478 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.491 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 24.4 mmt180 -50.4 -57.12 8.71 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.811 -169.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 24.8 p -59.44 -49.04 79.35 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.39 -177.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.559 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -59.22 -27.95 66.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.56 -176.456 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.493 ' HB2' HD13 ' A' ' 40' ' ' LEU . 31.5 t80 -55.3 -53.64 53.63 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.611 0.72 . . . . 0.0 109.783 174.435 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.493 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 6.4 mm-40 -69.66 -37.66 76.81 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.542 -1.208 . . . . 0.0 110.57 -177.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -62.56 -41.16 98.74 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.53 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 19.5 ttp -75.19 -50.39 16.38 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.026 0.441 . . . . 0.0 110.155 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 48.8 tp -61.55 -28.71 69.53 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.425 -177.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.493 ' HB2' ' O ' ' A' ' 46' ' ' GLU . 22.7 ttmm -57.96 -45.18 87.08 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.076 176.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.9 mm-40 -74.4 -40.81 61.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.158 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 65.19 46.22 88.45 Favored Glycine 0 N--CA 1.451 -0.317 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.374 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 20.8 p90 -104.49 -179.51 3.97 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -64.14 120.17 11.58 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.882 -177.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.6 p -54.59 108.24 1.09 Allowed Pre-proline 0 C--O 1.235 0.315 0 CA-C-O 120.77 0.319 . . . . 0.0 111.845 -178.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.47 ' O ' ' HG2' ' A' ' 59' ' ' MET . 40.6 Cg_endo -65.16 -19.19 62.78 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 122.784 2.323 . . . . 0.0 112.422 -174.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.585 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -71.59 -11.27 60.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.989 0.423 . . . . 0.0 110.323 -179.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -75.37 -22.96 57.11 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.901 173.087 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.47 ' HG2' ' O ' ' A' ' 56' ' ' PRO . 27.3 ptt? -108.77 -22.42 12.23 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.674 0.273 . . . . 0.0 111.061 -178.051 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.492 ' O ' ' HA ' ' A' ' 57' ' ' LEU . 3.9 m80 -142.66 121.99 13.1 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 178.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 29.2 t . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.813 -0.613 . . . . 0.0 109.776 -175.234 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 . . . . . 0 N--CA 1.482 1.143 0 CA-C-O 120.853 0.358 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -53.54 113.91 1.34 Allowed 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.383 -174.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 60.2 t -62.58 110.36 0.72 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.259 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.686 177.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 17.4 m -93.09 66.71 4.15 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.625 -176.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.481 ' OE1' ' HA ' ' A' ' 25' ' ' HIS . 8.3 tp-100 -161.21 149.25 15.58 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.619 178.048 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.801 HE22 ' HB2' ' A' ' 39' ' ' LEU . 25.6 tt0 -88.21 167.1 13.87 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 120.954 0.407 . . . . 0.0 110.863 -175.345 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -143.57 161.61 38.03 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.269 179.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.57 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 42.8 t -97.74 111.06 57.89 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.641 -177.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.424 ' HG2' ' HG ' ' A' ' 57' ' ' LEU . 72.0 Cg_endo -77.5 -12.34 16.94 Favored 'Trans proline' 0 CA--C 1.534 0.504 0 C-N-CA 122.259 1.973 . . . . 0.0 112.129 175.111 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.57 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 29.0 mm -59.85 -44.47 94.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-O 120.794 0.331 . . . . 0.0 110.808 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.562 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 27.8 p -132.0 15.72 4.7 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.539 -177.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 51.8 mt 52.41 72.28 0.41 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 121.28 0.562 . . . . 0.0 109.591 -175.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.562 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 21.1 tt0 -146.13 -176.45 5.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.311 -171.458 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.496 ' H ' ' HG2' ' A' ' 22' ' ' GLU . 16.0 t70 -86.82 156.35 19.92 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 122.543 0.337 . . . . 0.0 111.308 178.725 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.559 HG13 ' HB2' ' A' ' 17' ' ' CYS . 8.5 mt -148.87 105.1 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 169.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.481 ' HA ' ' OE1' ' A' ' 14' ' ' GLN . 1.8 p80 -76.1 136.65 39.85 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.535 -0.542 . . . . 0.0 109.535 172.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.7 m -52.81 -17.69 1.5 Allowed 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -171.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.6 m -52.35 106.42 0.15 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 120.857 0.36 . . . . 0.0 111.338 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -62.61 -24.39 67.56 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.111 -178.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.7 t -53.54 -30.67 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-O 121.079 0.466 . . . . 0.0 110.955 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 60.6 t -106.26 -47.09 8.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.452 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.57 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -79.55 107.0 11.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.703 -178.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.597 ' HB2' HH11 ' A' ' 42' ' ' ARG . 9.4 t60 -69.1 134.99 50.08 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.211 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.2 t -87.15 115.2 27.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.249 -178.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.651 HD12 ' HB2' ' A' ' 38' ' ' HIS . 43.0 mt -72.01 147.82 91.37 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.99 170.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -55.61 -24.64 46.18 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.818 2.345 . . . . 0.0 112.498 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.9 t -88.72 5.92 41.06 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.761 -177.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.24 23.66 33.9 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 121.315 -0.469 . . . . 0.0 113.54 173.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.651 ' HB2' HD12 ' A' ' 34' ' ' LEU . 70.3 m-70 -102.89 155.61 18.23 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.9 0.35 . . . . 0.0 111.013 178.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.801 ' HB2' HE22 ' A' ' 15' ' ' GLN . 81.1 mt -115.71 136.93 52.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.343 175.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.584 HD21 HD11 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -160.26 146.36 15.44 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.747 0.308 . . . . 0.0 111.101 175.222 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.549 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -58.91 157.65 9.51 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.223 178.39 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.597 HH11 ' HB2' ' A' ' 32' ' ' HIS . 26.2 mmt180 -46.57 -58.37 3.87 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.567 -171.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.445 ' O ' ' HG2' ' A' ' 47' ' ' GLU . 28.4 m -57.65 -48.26 79.98 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.003 0.43 . . . . 0.0 110.93 -177.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.549 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -61.01 -28.74 69.26 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.921 -179.214 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.559 ' HB2' HD13 ' A' ' 40' ' ' LEU . 39.6 t80 -65.16 -55.29 19.49 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.501 177.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -61.5 -48.22 82.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.265 -175.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 43' ' ' THR . 48.6 mm-40 -59.69 -45.48 91.95 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -175.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 18.9 ttp -65.87 -44.99 83.73 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.029 0.442 . . . . 0.0 110.053 -179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 42.8 tp -68.89 -28.15 66.43 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.766 -179.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.443 ' HE2' ' HB3' ' A' ' 50' ' ' LYS . 4.7 tmmm? -68.45 -33.85 74.92 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.049 179.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -76.98 -56.23 4.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.593 173.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 91.0 14.68 57.44 Favored Glycine 0 C--N 1.332 0.314 0 CA-C-N 115.842 -0.617 . . . . 0.0 113.334 175.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 21.9 p90 -75.38 173.55 10.77 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 117.007 0.404 . . . . 0.0 110.333 177.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 -56.7 128.03 34.42 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.551 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.2 p -54.26 109.62 1.64 Allowed Pre-proline 0 C--O 1.235 0.306 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.546 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.459 ' HG2' HD13 ' A' ' 19' ' ' ILE . 23.9 Cg_endo -60.78 -25.93 82.06 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.729 2.286 . . . . 0.0 112.658 -175.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.571 HD22 ' HB3' ' A' ' 38' ' ' HIS . 3.9 mp -65.46 -15.68 62.88 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 120.902 0.382 . . . . 0.0 110.967 -177.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -73.93 -32.71 63.64 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.581 176.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 83.1 mmm -109.43 -18.36 13.56 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 120.938 0.399 . . . . 0.0 111.365 -175.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.41 ' O ' ' HA ' ' A' ' 57' ' ' LEU . 75.9 m80 -134.09 134.79 42.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.56 -175.111 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 9.9 p . . . . . 0 C--O 1.251 1.146 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.546 176.84 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 . . . . . 0 N--CA 1.479 0.999 0 CA-C-O 120.876 0.369 . . . . 0.0 110.135 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -112.14 40.21 2.24 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.094 0.473 . . . . 0.0 110.833 -177.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 13.8 p -77.24 -30.55 17.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.898 -178.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.0 m -81.4 -17.15 49.94 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.774 -178.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -79.98 122.94 27.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.35 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -62.95 124.83 22.09 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.009 177.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 34.8 p30 -148.44 162.09 40.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.021 0.439 . . . . 0.0 110.391 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.605 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 35.5 t -99.11 109.29 53.72 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.333 -177.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -74.24 -16.56 22.21 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.451 2.101 . . . . 0.0 111.557 175.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.605 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 34.4 mm -61.03 -25.89 37.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.022 -179.048 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 27.6 p -156.7 18.4 0.32 Allowed 'General case' 0 N--CA 1.466 0.349 0 O-C-N 122.41 -0.181 . . . . 0.0 111.335 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 80.2 mt 56.27 39.88 30.07 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.916 0.388 . . . . 0.0 111.507 177.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -118.29 174.33 6.29 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.183 -178.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -67.69 153.51 43.54 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.357 -175.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.514 HD11 ' HA ' ' A' ' 40' ' ' LEU . 1.8 mt -153.87 146.16 14.19 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 CA-C-N 115.287 -0.87 . . . . 0.0 108.986 171.435 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 24.0 m80 -149.25 -170.14 3.55 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 122.328 0.251 . . . . 0.0 110.564 178.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.487 ' O ' ' HD2' ' A' ' 28' ' ' ARG . 51.7 p -62.99 -17.55 62.26 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -173.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.5 m -57.54 99.45 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 111.536 0.199 . . . . 0.0 111.536 -178.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.52 ' H ' ' HD2' ' A' ' 28' ' ' ARG . 5.2 mpt_? -71.57 -28.73 64.04 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.191 0.52 . . . . 0.0 110.134 178.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 46.7 t -62.67 -38.14 80.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.079 177.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.538 ' O ' ' HA ' ' A' ' 41' ' ' HIS . 60.9 t -82.32 -62.62 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.85 -0.613 . . . . 0.0 109.658 176.398 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.527 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -85.69 98.72 10.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.491 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -61.98 143.45 56.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.34 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 40.2 t -86.89 115.58 27.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.363 -177.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.643 HD12 ' HB2' ' A' ' 38' ' ' HIS . 32.2 mt -67.39 151.79 96.81 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.812 173.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -59.15 -19.02 47.29 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.87 2.38 . . . . 0.0 111.896 174.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 32.5 t -99.51 18.17 18.55 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.501 -178.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.91 15.19 79.62 Favored Glycine 0 C--N 1.338 0.666 0 N-CA-C 114.706 0.642 . . . . 0.0 114.706 169.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.645 ' HB3' HD22 ' A' ' 57' ' ' LEU . 36.3 m-70 -103.0 157.39 17.01 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 117.58 0.69 . . . . 0.0 111.041 178.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.527 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 97.6 mt -108.57 138.54 44.71 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.849 177.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.537 HD21 HD11 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -158.91 138.9 12.04 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 122.83 0.452 . . . . 0.0 110.482 174.125 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.538 ' HA ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -56.46 163.5 1.72 Allowed 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.674 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.407 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 18.6 mmt180 -43.15 -64.72 0.58 Allowed 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 114.884 -1.053 . . . . 0.0 112.551 -173.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 24.3 p -56.56 -47.47 79.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.114 0.483 . . . . 0.0 110.923 -177.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.489 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.5 OUTLIER -61.98 -28.75 69.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.232 -179.671 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.522 ' HB2' HD13 ' A' ' 40' ' ' LEU . 53.5 t80 -68.63 -53.14 24.42 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.047 0.451 . . . . 0.0 110.034 176.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -62.28 -45.07 94.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.741 -177.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.1 mm-40 -59.85 -54.52 45.28 Favored 'General case' 0 C--O 1.234 0.261 0 O-C-N 123.129 0.268 . . . . 0.0 111.609 178.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.471 ' HA ' ' CE1' ' A' ' 53' ' ' TYR . 6.8 ttp -58.94 -40.79 85.72 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.131 0.491 . . . . 0.0 110.175 -176.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.1 tp -75.85 -29.91 58.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.875 -178.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 50.1 tttm -65.51 -51.11 62.34 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.257 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -71.24 -31.45 67.56 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.932 174.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 62.38 38.59 96.52 Favored Glycine 0 N--CA 1.452 -0.28 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.458 177.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.471 ' CE1' ' HA ' ' A' ' 48' ' ' MET . 41.1 p90 -88.12 -175.95 5.24 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.786 0.327 . . . . 0.0 110.634 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.847 ' H ' ' HD2' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -75.22 144.77 42.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.355 -173.951 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.5 p -84.27 107.09 9.69 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.805 -178.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -67.23 -13.52 39.82 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 122.516 2.144 . . . . 0.0 111.811 179.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.645 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -74.99 -6.75 51.02 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.44 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -73.5 -24.8 60.22 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 173.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.445 ' C ' ' SD ' ' A' ' 59' ' ' MET . 0.8 OUTLIER -87.33 -47.79 8.52 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.522 174.212 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 76.7 t60 -105.07 102.73 12.21 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.009 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 70.7 m . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.907 -0.568 . . . . 0.0 109.807 176.055 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 . . . . . 0 N--CA 1.481 1.093 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -101.95 116.72 33.32 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.8 t -102.4 -47.85 10.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.958 0.408 . . . . 0.0 110.679 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.1 t -88.91 5.16 45.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.366 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -136.09 146.18 46.74 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.583 HE22 HG23 ' A' ' 26' ' ' THR . 1.7 mp0 -88.65 153.79 20.83 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 121.055 0.455 . . . . 0.0 110.351 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -124.07 150.24 45.21 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.981 175.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.526 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 10.6 t -90.38 108.99 30.54 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.805 -176.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -68.96 -11.37 31.66 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.256 1.971 . . . . 0.0 112.041 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.526 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 26.5 mm -71.87 -21.1 20.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.875 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.417 ' SG ' ' CG ' ' A' ' 22' ' ' GLU . 21.8 p -164.12 17.49 0.06 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 120.944 -0.303 . . . . 0.0 111.776 -179.483 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.419 ' N ' ' O ' ' A' ' 17' ' ' CYS . 60.1 mt 53.67 31.08 12.06 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.417 ' CG ' ' SG ' ' A' ' 20' ' ' CYS . 56.4 mm-40 -101.97 -177.59 3.46 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.23 178.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -74.75 148.4 40.47 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -174.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.512 HD11 ' HA ' ' A' ' 40' ' ' LEU . 4.5 mt -149.72 124.0 1.68 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 C-N-CA 123.38 0.672 . . . . 0.0 109.924 170.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 18.1 t-80 -108.5 157.82 18.1 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 177.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.583 HG23 HE22 ' A' ' 15' ' ' GLN . 13.3 p -54.06 -22.48 10.87 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -179.67 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 9.6 m -61.94 100.51 0.16 Allowed 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.018 0.437 . . . . 0.0 110.555 177.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.9 ppt_? -81.18 16.81 1.43 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.532 -176.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 56.4 t -71.21 -47.63 59.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 172.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.419 ' O ' ' HA ' ' A' ' 41' ' ' HIS . 7.8 p -86.1 -38.4 12.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.199 175.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.511 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -86.76 101.86 13.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.67 -179.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -59.52 137.14 58.11 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.362 178.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 30.6 t -86.25 108.81 18.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.593 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.677 HD12 ' HB2' ' A' ' 38' ' ' HIS . 43.2 mt -66.9 151.04 97.4 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.286 173.519 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.4 -24.59 69.42 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.726 2.284 . . . . 0.0 112.237 179.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 43.0 t -91.13 7.73 39.15 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.65 -177.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.98 22.54 45.11 Favored Glycine 0 C--N 1.337 0.588 0 CA-C-N 116.103 -0.499 . . . . 0.0 113.872 172.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.677 ' HB2' HD12 ' A' ' 34' ' ' LEU . 78.0 m-70 -101.64 155.94 17.8 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 117.263 0.531 . . . . 0.0 110.784 177.07 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.511 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 71.0 mt -115.75 136.38 53.11 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.558 177.066 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.593 HD21 HD11 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -161.19 140.31 10.19 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.005 175.368 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.583 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -53.65 153.09 4.62 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.604 0.24 . . . . 0.0 111.518 179.354 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.477 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 15.3 mmt180 -44.24 -57.04 3.69 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.941 0.897 . . . . 0.0 112.203 -172.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.456 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 61.1 m -52.7 -49.35 65.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.04 -178.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.583 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -65.1 -30.87 71.85 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.029 -177.914 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.509 ' HB2' HD13 ' A' ' 40' ' ' LEU . 13.3 t80 -60.88 -50.31 73.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.98 175.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.471 ' O ' ' HG3' ' A' ' 50' ' ' LYS . 47.6 mt-10 -64.87 -41.43 95.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.592 -179.239 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 43' ' ' THR . 43.8 mt-10 -55.65 -55.36 33.05 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.998 0.428 . . . . 0.0 110.835 177.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 15.6 ttp -65.49 -40.92 93.63 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.918 -175.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 34.9 tp -73.84 -28.76 61.76 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.552 -173.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.471 ' HG3' ' O ' ' A' ' 46' ' ' GLU . 56.5 mttp -57.26 -47.73 80.68 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.104 0.478 . . . . 0.0 110.049 175.504 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -70.27 -39.18 75.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.61 173.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 64.63 19.76 65.3 Favored Glycine 0 N--CA 1.45 -0.416 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.257 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.2 p90 -70.75 173.94 6.62 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 120.761 0.315 . . . . 0.0 110.651 -177.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 67.9 mtt180 -65.04 122.9 18.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.532 -175.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.423 ' HA ' ' HD2' ' A' ' 56' ' ' PRO . 1.4 p -54.12 112.46 3.88 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.772 -173.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' ' 55' ' ' CYS . 34.3 Cg_endo -63.73 -24.86 68.68 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.73 2.287 . . . . 0.0 112.332 -178.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.57 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.6 mp -66.65 -14.42 62.44 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 120.762 0.315 . . . . 0.0 110.823 -178.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -75.36 -28.82 59.69 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.976 174.113 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.425 ' HG3' ' HD2' ' A' ' 60' ' ' HIS . 23.8 ptp -109.78 -14.02 14.38 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 -175.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.425 ' HD2' ' HG3' ' A' ' 59' ' ' MET . 62.4 m-70 -147.02 166.56 26.45 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 122.512 0.325 . . . . 0.0 110.149 178.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 40.9 m . . . . . 0 C--O 1.253 1.242 0 CA-C-O 119.011 -0.519 . . . . 0.0 109.647 178.813 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 . . . . . 0 N--CA 1.482 1.128 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -161.35 145.88 13.38 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.101 -178.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 27.6 m -65.51 -27.36 41.48 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.199 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.3 p -108.01 156.23 19.46 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.307 177.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.466 ' NE2' HG23 ' A' ' 26' ' ' THR . 28.7 tt0 -66.08 -57.07 8.53 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.8 mp0 -123.89 141.15 52.29 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 168.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -101.43 135.88 42.2 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.226 0.536 . . . . 0.0 110.568 -177.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.556 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 11.1 t -82.37 108.45 11.86 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.63 177.193 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.85 -11.52 29.53 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.171 1.914 . . . . 0.0 111.539 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.556 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 21.0 mm -69.5 -25.81 29.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.684 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.803 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 17.4 p -165.21 22.77 0.05 Allowed 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -177.025 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 90.9 mt 59.03 24.71 12.99 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 176.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.803 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 0.3 OUTLIER -97.33 171.21 8.56 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 -177.515 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -76.34 150.75 36.84 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.977 0.417 . . . . 0.0 111.239 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.467 HD13 ' O ' ' A' ' 39' ' ' LEU . 7.4 mt -144.12 121.9 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.261 172.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 -105.05 159.71 15.61 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.933 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.541 ' O ' ' HD3' ' A' ' 28' ' ' ARG . 0.9 OUTLIER -59.33 -17.5 29.99 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -177.714 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.3 m -59.63 104.89 0.31 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.631 -0.259 . . . . 0.0 111.687 -177.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.541 ' HD3' ' O ' ' A' ' 26' ' ' THR . 1.7 mpp_? -66.88 -14.61 62.93 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.776 0.322 . . . . 0.0 110.683 176.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 58.4 t -69.99 -33.22 54.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.554 176.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 59.2 t -98.24 -50.58 11.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.275 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.516 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -93.09 113.29 25.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.254 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -62.16 128.29 35.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.739 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.413 ' HA ' HD23 ' A' ' 39' ' ' LEU . 7.2 p -83.66 121.52 36.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.269 0.557 . . . . 0.0 111.337 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.62 HD12 ' HB2' ' A' ' 38' ' ' HIS . 94.9 mt -73.05 154.34 90.72 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.647 174.692 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -62.64 -9.99 17.96 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.779 2.319 . . . . 0.0 112.251 178.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.8 t -107.23 17.46 22.88 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.207 0.527 . . . . 0.0 109.847 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.56 -14.89 63.75 Favored Glycine 0 C--N 1.341 0.84 0 N-CA-C 114.966 0.746 . . . . 0.0 114.966 168.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.62 ' HB2' HD12 ' A' ' 34' ' ' LEU . 14.2 m-70 -81.78 156.7 24.8 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 117.572 0.686 . . . . 0.0 111.385 -173.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.516 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 97.5 mt -109.65 145.27 36.77 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.282 177.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.513 HD21 HD11 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -157.96 152.43 24.73 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 174.047 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.45 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -70.59 171.81 9.64 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.76 0.314 . . . . 0.0 111.379 -179.577 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.476 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 12.3 mmm180 -46.48 -67.25 0.3 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.775 -173.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 22.3 m -60.71 -43.86 97.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.06 0.457 . . . . 0.0 110.681 -175.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.45 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.6 OUTLIER -63.68 -23.94 67.58 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.586 -176.27 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.512 ' HB2' HD13 ' A' ' 40' ' ' LEU . 34.4 t80 -61.4 -50.3 73.42 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 173.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.412 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 49.0 mt-10 -67.67 -41.21 84.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.721 -179.126 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -56.62 -51.03 70.23 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.489 -177.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 13.6 ttp -70.18 -49.52 49.55 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.933 0.397 . . . . 0.0 110.656 -177.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.4 tp -62.2 -34.77 77.1 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.913 -176.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 46' ' ' GLU . 38.6 ttmt -55.06 -48.04 74.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.286 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -68.9 -43.9 74.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.208 177.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.78 18.89 79.42 Favored Glycine 0 CA--C 1.519 0.287 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.861 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.439 ' CE2' ' HD3' ' A' ' 56' ' ' PRO . 13.7 p90 -79.06 176.9 9.23 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 178.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 79.2 mtp180 -62.41 119.47 9.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.613 0.244 . . . . 0.0 110.353 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.487 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 0.5 OUTLIER -51.37 113.87 4.41 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.51 178.426 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.439 ' HD3' ' CE2' ' A' ' 53' ' ' TYR . 35.0 Cg_endo -63.78 -17.59 60.51 Favored 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 122.519 2.146 . . . . 0.0 111.534 -178.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.496 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.8 mp -75.92 -2.66 31.35 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.143 179.074 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.5 OUTLIER -74.2 -16.1 60.99 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 171.461 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 62.7 mtm -105.8 -4.9 20.3 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.225 175.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -144.0 95.86 2.8 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.054 179.097 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 32.3 t . . . . . 0 C--O 1.25 1.122 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.128 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.417 ' OE1' HG22 ' A' ' 12' ' ' VAL . 0.3 OUTLIER . . . . . 0 N--CA 1.484 1.273 0 CA-C-O 120.797 0.332 . . . . 0.0 111.016 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -160.16 66.7 0.35 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.437 0.637 . . . . 0.0 109.309 174.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.417 HG22 ' OE1' ' A' ' 10' ' ' GLU . 25.7 m -85.42 71.69 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.623 0.725 . . . . 0.0 111.304 -178.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.1 t -82.24 86.39 6.67 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 175.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -136.51 113.04 10.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.382 -175.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.634 ' O ' ' HB ' ' A' ' 24' ' ' ILE . 85.3 mm-40 -90.87 81.87 5.7 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 176.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.522 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 32.6 m-80 -60.99 139.45 58.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.723 -174.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.572 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 12.8 t -71.2 110.23 6.93 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.518 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.522 ' HD3' ' O ' ' A' ' 16' ' ' ASN . 5.0 Cg_exo -75.06 -13.44 21.28 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.547 2.164 . . . . 0.0 110.864 174.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.572 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 11.9 mm -66.0 -27.0 39.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.856 -176.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.444 ' SG ' ' OE2' ' A' ' 22' ' ' GLU . 18.3 p -165.15 20.41 0.05 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 111.672 0.249 . . . . 0.0 111.672 -178.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 90.8 mt 55.73 89.65 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.81 0.338 . . . . 0.0 111.186 -177.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.444 ' OE2' ' SG ' ' A' ' 20' ' ' CYS . 26.6 mt-10 -157.09 171.86 19.7 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.651 -179.571 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -83.3 145.62 28.99 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.996 175.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.634 ' HB ' ' O ' ' A' ' 15' ' ' GLN . 34.2 mt -138.75 111.73 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.34 173.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -80.35 150.92 29.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.683 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 16.3 p -57.74 -17.87 17.96 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -177.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.4 m -66.3 97.21 0.39 Allowed 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.735 0.302 . . . . 0.0 110.934 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.652 ' H ' ' HD3' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -78.09 11.41 2.31 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.101 0.477 . . . . 0.0 111.344 -179.046 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 37.4 t -74.39 -45.36 46.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 172.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.6 p -87.58 -44.81 16.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.052 178.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.85 112.89 18.65 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.233 -0.439 . . . . 0.0 109.946 177.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.403 ' O ' HD12 ' A' ' 40' ' ' LEU . 19.2 t60 -61.08 131.02 49.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.298 -178.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.43 ' HA ' HD23 ' A' ' 39' ' ' LEU . 7.3 p -86.36 120.61 36.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.017 179.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.6 HD12 ' HB2' ' A' ' 38' ' ' HIS . 76.2 mt -74.86 153.37 86.96 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.074 173.26 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.5 -18.13 58.91 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.295 1.996 . . . . 0.0 111.674 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 37.0 t -90.76 9.03 31.67 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.328 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.18 19.21 57.79 Favored Glycine 0 C--N 1.338 0.666 0 CA-C-N 116.112 -0.495 . . . . 0.0 114.127 171.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.6 ' HB2' HD12 ' A' ' 34' ' ' LEU . 61.2 m-70 -104.18 157.15 17.32 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 117.4 0.6 . . . . 0.0 111.1 177.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' A' ' 33' ' ' VAL . 93.5 mt -113.52 143.93 43.7 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.358 175.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.558 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -159.18 148.02 18.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.477 175.615 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.561 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.1 OUTLIER -58.25 151.76 18.71 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.446 175.858 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.472 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 17.5 mmt85 -47.84 -57.44 5.64 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.842 0.714 . . . . 0.0 112.092 -170.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.441 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 20.2 m -53.63 -40.43 65.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.171 0.51 . . . . 0.0 111.387 -178.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.561 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -72.14 -25.35 61.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.999 -176.058 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.558 ' HB2' HD13 ' A' ' 40' ' ' LEU . 20.5 t80 -61.2 -46.64 89.62 Favored 'General case' 0 C--O 1.232 0.143 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 173.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.73 -51.0 71.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.288 176.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 43' ' ' THR . 42.4 mt-10 -54.65 -55.87 25.03 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.615 -177.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 10.1 ttp -63.35 -44.95 93.38 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.777 -175.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 64.9 tp -64.09 -34.02 77.09 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.649 -177.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.424 ' HB3' ' NZ ' ' A' ' 50' ' ' LYS . 8.8 mtpm? -67.86 -50.23 57.65 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.972 0.415 . . . . 0.0 110.658 176.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -63.61 -29.35 70.61 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.85 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 60.93 23.71 61.79 Favored Glycine 0 C--N 1.332 0.319 0 CA-C-N 115.829 -0.623 . . . . 0.0 113.328 174.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -85.8 169.21 13.58 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 110.333 -0.247 . . . . 0.0 110.333 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 38.0 mmt180 -58.1 127.22 30.99 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.709 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 1.2 p -60.79 106.33 0.76 Allowed Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.214 178.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -65.93 -18.08 56.75 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.714 2.276 . . . . 0.0 112.272 -174.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.573 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.7 mp -68.76 -17.3 64.02 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.153 178.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.7 OUTLIER -66.18 -17.37 64.68 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.991 0.425 . . . . 0.0 110.422 174.23 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 27.3 ttt -89.18 -11.17 44.52 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.401 177.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 -128.11 99.23 5.39 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.781 -178.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.8 p . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.787 -0.625 . . . . 0.0 109.679 175.7 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.481 1.124 0 CA-C-O 121.222 0.534 . . . . 0.0 111.387 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 -157.14 129.46 7.37 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.057 168.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.7 t -73.41 109.77 6.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.982 -175.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.1 p -81.17 -33.17 33.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.577 177.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -66.16 104.92 1.26 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.638 178.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.477 ' HB3' HG22 ' A' ' 24' ' ' ILE . 6.4 tp-100 -77.25 145.97 37.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.112 -173.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -106.65 142.62 36.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.112 0.482 . . . . 0.0 109.865 174.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.453 ' HB2' HG13 ' A' ' 24' ' ' ILE . 33.3 t -85.98 111.09 35.67 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.793 -178.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.506 ' HG2' ' HG ' ' A' ' 57' ' ' LEU . 17.2 Cg_exo -64.91 -19.01 63.9 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.353 2.036 . . . . 0.0 111.398 179.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.473 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 11.7 mm -76.65 -12.41 14.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.812 -173.328 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.451 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 20.2 p -171.68 19.36 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 77.9 mt 60.08 16.35 5.86 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 176.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.451 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 27.6 mm-40 -97.0 173.28 7.36 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.564 0.221 . . . . 0.0 111.105 -177.016 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -69.83 153.52 43.2 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 116.172 -0.467 . . . . 0.0 112.087 -175.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.477 HG22 ' HB3' ' A' ' 15' ' ' GLN . 4.3 mt -150.32 131.53 4.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 123.558 0.743 . . . . 0.0 109.431 172.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 52.3 m80 -114.46 168.85 9.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.83 177.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 14.5 t -70.23 -17.2 63.13 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.656 -175.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.7 p -69.32 133.12 47.46 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.644 177.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.689 ' HD2' ' H ' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -97.74 11.14 38.17 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.383 -176.915 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 64.0 t -58.67 -50.05 80.49 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-O 120.954 0.407 . . . . 0.0 110.289 178.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 49.4 t -100.95 -32.77 3.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.073 177.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.597 ' HA ' ' HA ' ' A' ' 41' ' ' HIS . . . -86.72 104.54 16.21 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.285 -178.293 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.2 t60 -65.21 131.53 46.75 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.3 p -89.56 115.46 29.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.025 0.441 . . . . 0.0 110.743 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.632 HD12 ' HB2' ' A' ' 38' ' ' HIS . 86.6 mt -64.5 153.41 86.94 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.086 175.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -67.26 -10.59 29.15 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.27 1.98 . . . . 0.0 111.364 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 38.6 t -97.03 9.67 41.43 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.386 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.95 17.38 59.64 Favored Glycine 0 C--N 1.338 0.68 0 N-CA-C 114.33 0.492 . . . . 0.0 114.33 171.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.648 ' HB3' HD22 ' A' ' 57' ' ' LEU . 25.4 m-70 -103.84 156.08 18.11 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 117.499 0.649 . . . . 0.0 110.945 178.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 71.5 mt -112.9 135.92 53.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.946 0.403 . . . . 0.0 110.95 176.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.515 HD21 HD11 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -155.09 137.0 14.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.11 173.654 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 31' ' ' ALA . 0.0 OUTLIER -58.0 163.48 2.75 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.884 0.374 . . . . 0.0 111.934 -177.952 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.45 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 16.1 mmm180 -37.59 -69.01 0.13 Allowed 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 114.463 -1.244 . . . . 0.0 113.204 -174.301 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 53.3 m -63.22 -35.74 81.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.005 0.431 . . . . 0.0 111.292 -174.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.499 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -68.45 -24.05 64.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.175 -177.284 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.45 ' HB3' ' O ' ' A' ' 42' ' ' ARG . 30.1 t80 -60.82 -43.71 97.86 Favored 'General case' 0 C--O 1.232 0.179 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 173.191 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.454 ' HB3' ' HE2' ' A' ' 50' ' ' LYS . 41.6 mt-10 -64.43 -48.46 75.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.091 177.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.574 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 43.6 mt-10 -54.04 -57.01 12.65 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.501 -176.184 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 11.4 ttp -63.96 -47.72 79.31 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.064 0.459 . . . . 0.0 110.574 -175.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.0 tp -61.73 -38.16 86.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.284 -175.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.454 ' HE2' ' HB3' ' A' ' 46' ' ' GLU . 68.9 mttm -71.25 -35.37 71.4 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.57 0.224 . . . . 0.0 111.017 -179.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.574 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 8.1 mm-40 -59.52 -31.59 69.53 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.004 0.43 . . . . 0.0 110.487 178.053 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.59 -4.34 60.55 Favored Glycine 0 CA--C 1.518 0.261 0 CA-C-N 115.797 -0.638 . . . . 0.0 114.065 171.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -73.12 166.75 22.51 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 117.677 0.738 . . . . 0.0 110.723 179.2 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 63.3 mtm180 -65.44 135.62 55.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.246 -0.434 . . . . 0.0 109.89 177.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 0.9 OUTLIER -54.14 109.72 1.69 Allowed Pre-proline 0 C--N 1.327 -0.37 0 O-C-N 123.304 0.377 . . . . 0.0 112.01 -178.195 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -66.49 -17.62 53.56 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.64 2.226 . . . . 0.0 111.877 -178.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.648 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -70.82 -8.71 54.49 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.177 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.5 OUTLIER -70.81 -22.09 62.39 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.292 0.568 . . . . 0.0 109.85 174.245 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.567 ' N ' ' SD ' ' A' ' 59' ' ' MET . 1.1 mpt? -105.93 8.77 32.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.019 179.18 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -157.75 96.92 1.53 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.952 -174.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 71.1 m . . . . . 0 C--O 1.247 0.969 0 CA-C-O 118.599 -0.715 . . . . 0.0 109.779 176.836 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 . . . . . 0 N--CA 1.48 1.071 0 CA-C-O 120.693 0.282 . . . . 0.0 110.38 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -177.26 126.58 0.15 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.738 179.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 65.2 t -76.7 89.39 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.1 0.476 . . . . 0.0 110.554 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 65.1 p -168.21 118.71 0.79 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.744 177.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 23.7 mp0 -64.08 -43.22 96.06 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 178.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 67.0 mm-40 -141.84 164.03 31.29 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.257 174.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 -136.61 150.5 48.58 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.256 -0.429 . . . . 0.0 109.995 -179.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.635 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 13.4 t -96.78 110.52 53.82 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.134 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -68.63 -20.82 40.22 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.188 1.925 . . . . 0.0 111.097 175.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.635 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 19.3 mm -63.67 -25.51 38.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.241 -177.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.48 ' SG ' ' CG ' ' A' ' 22' ' ' GLU . 18.7 p -166.42 25.41 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.709 0.29 . . . . 0.0 111.597 -179.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 61.1 mt 54.78 21.96 3.88 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 112.867 0.692 . . . . 0.0 112.867 176.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.48 ' CG ' ' SG ' ' A' ' 20' ' ' CYS . 35.5 mm-40 -93.17 162.58 13.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.732 0.301 . . . . 0.0 110.962 -178.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -62.94 151.67 38.78 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.801 -179.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.2 mt -148.6 124.13 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.41 173.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -105.07 172.03 7.01 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 110.083 -0.339 . . . . 0.0 110.083 175.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.4 m -71.32 -18.75 62.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.724 -174.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.484 ' OG ' HG12 ' A' ' 29' ' ' VAL . 20.6 t -58.23 106.81 0.41 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 120.961 0.41 . . . . 0.0 110.87 -179.45 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.5 8.21 17.27 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.212 -175.407 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.484 HG12 ' OG ' ' A' ' 27' ' ' SER . 14.6 p -81.94 -38.95 16.21 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-O 121.006 0.432 . . . . 0.0 109.836 174.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.4 p -94.22 -44.46 13.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.013 177.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -87.47 97.9 11.09 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 175.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 8.8 t60 -58.49 127.36 31.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.498 -176.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.1 p -81.97 114.31 22.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.134 0.493 . . . . 0.0 110.736 179.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.623 HD12 ' HB2' ' A' ' 38' ' ' HIS . 76.8 mt -65.17 152.8 90.79 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.147 174.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.44 -3.65 12.24 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.348 2.032 . . . . 0.0 111.287 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 36.1 t -105.49 10.11 33.32 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.278 178.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 87.57 16.01 60.89 Favored Glycine 0 C--N 1.339 0.706 0 N-CA-C 114.92 0.728 . . . . 0.0 114.92 170.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.624 ' HB3' HD22 ' A' ' 57' ' ' LEU . 43.8 m-70 -104.3 156.5 17.86 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 117.759 0.779 . . . . 0.0 110.84 177.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 95.4 mt -113.3 137.19 51.86 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 122.533 0.333 . . . . 0.0 110.717 177.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.523 HD21 HD11 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -156.24 141.05 17.1 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.251 174.326 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.535 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -55.72 159.34 3.08 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.915 0.388 . . . . 0.0 111.701 179.71 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.515 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 21.5 mmt85 -42.4 -66.07 0.4 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 114.856 -1.065 . . . . 0.0 112.999 -172.217 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 25.2 m -61.67 -37.91 85.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.913 0.387 . . . . 0.0 111.056 -174.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.535 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -66.72 -26.83 67.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.945 179.852 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.515 ' HB3' ' O ' ' A' ' 42' ' ' ARG . 38.2 t80 -63.7 -48.61 76.39 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 174.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -61.74 -43.78 98.19 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.171 179.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.556 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 79.2 mm-40 -57.93 -56.58 20.16 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.844 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 8.5 ttp -61.52 -44.56 96.84 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.097 0.475 . . . . 0.0 110.411 -175.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 49.2 tp -66.39 -32.02 73.15 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.297 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.3 ttpp -68.64 -42.91 77.33 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.56 177.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.556 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 30.2 mm-40 -65.58 -37.81 87.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.836 177.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 64.8 39.09 96.35 Favored Glycine 0 C--N 1.333 0.379 0 CA-C-N 115.589 -0.732 . . . . 0.0 113.132 176.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 6.3 p90 -106.62 177.46 4.85 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.645 0.259 . . . . 0.0 110.693 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 34.6 mmt180 -64.39 119.18 9.87 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.004 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.455 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 0.8 OUTLIER -55.63 107.83 1.0 Allowed Pre-proline 0 CA--C 1.532 0.26 0 O-C-N 123.333 0.396 . . . . 0.0 111.513 -179.169 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -63.8 -21.18 69.41 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 122.697 2.265 . . . . 0.0 111.829 -175.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.624 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -69.48 -11.3 60.71 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.434 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.1 OUTLIER -68.18 -19.07 64.75 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.159 0.504 . . . . 0.0 110.211 176.353 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 86.6 mtp -102.88 20.07 18.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.687 176.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 74.3 t60 -139.62 135.87 33.76 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.016 -176.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.0 m . . . . . 0 C--O 1.249 1.043 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.139 175.688 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 . . . . . 0 N--CA 1.481 1.098 0 CA-C-O 120.867 0.365 . . . . 0.0 110.574 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 39.7 t-20 -148.9 136.64 20.53 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 65.7 t -61.29 109.55 0.54 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-O 120.831 0.348 . . . . 0.0 110.748 -178.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.0 p -162.94 146.76 11.14 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.244 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -73.83 -65.28 0.85 Allowed 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 176.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -117.82 149.2 41.21 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 174.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -98.54 140.16 33.2 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.924 0.392 . . . . 0.0 110.082 -178.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.554 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 39.1 t -91.07 108.1 25.81 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.183 174.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -72.68 -12.55 26.76 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.206 1.937 . . . . 0.0 111.189 176.343 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.554 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 14.3 mm -71.34 -15.18 18.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.988 -178.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.427 ' SG ' ' CG ' ' A' ' 22' ' ' GLU . 18.0 p -173.55 22.49 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 179.413 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 88.1 mt 58.73 24.66 12.49 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 176.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.427 ' CG ' ' SG ' ' A' ' 20' ' ' CYS . 42.9 mm-40 -99.15 159.92 14.64 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.668 0.271 . . . . 0.0 111.43 -177.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.25 148.27 52.08 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.206 177.3 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.486 HD13 ' O ' ' A' ' 39' ' ' LEU . 7.4 mt -138.44 120.8 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-O 121.087 0.47 . . . . 0.0 110.558 174.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 23.2 m80 -99.18 175.22 5.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.983 174.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 49.3 p -75.29 -39.65 59.46 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -173.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 35.5 t -45.32 117.85 1.53 Allowed 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.459 0.474 . . . . 0.0 112.202 -173.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.48 ' HA ' ' O ' ' A' ' 31' ' ' ALA . 0.0 OUTLIER -60.51 -20.83 61.43 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.053 179.463 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.2 t -57.55 -47.92 84.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-O 120.988 0.423 . . . . 0.0 110.397 179.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.525 ' O ' ' HA ' ' A' ' 41' ' ' HIS . 60.0 t -91.32 -50.59 12.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.324 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.544 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -99.79 102.78 14.31 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.06 -177.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.6 t60 -66.45 138.65 57.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.755 176.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 8.6 p -90.73 122.32 41.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-O 121.293 0.568 . . . . 0.0 111.254 -178.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.64 HD12 ' HB2' ' A' ' 38' ' ' HIS . 70.1 mt -72.28 154.56 92.0 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.615 174.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -58.03 -24.18 64.31 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 122.621 2.214 . . . . 0.0 112.201 177.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 48.0 t -89.72 9.03 28.71 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.575 -178.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.74 22.43 53.3 Favored Glycine 0 C--N 1.337 0.594 0 C-N-CA 121.415 -0.422 . . . . 0.0 113.665 173.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.64 ' HB2' HD12 ' A' ' 34' ' ' LEU . 71.4 m-70 -101.37 157.26 16.93 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 122.449 -0.442 . . . . 0.0 110.95 177.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.544 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 95.1 mt -112.56 137.38 50.87 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.982 174.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.529 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -154.28 142.83 20.73 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 174.205 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.525 ' HA ' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -62.94 159.86 16.03 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.778 0.323 . . . . 0.0 111.576 -179.88 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.532 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 24.9 mmm180 -37.39 -67.64 0.18 Allowed 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 114.772 -1.104 . . . . 0.0 113.378 -174.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 89.4 m -60.95 -42.46 98.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.929 0.395 . . . . 0.0 111.154 -175.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.5 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -63.28 -25.73 68.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.078 -177.514 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.532 ' HB3' ' O ' ' A' ' 42' ' ' ARG . 44.3 t80 -60.13 -47.02 87.66 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 174.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -67.23 -42.73 83.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.183 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -54.93 -55.28 32.4 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.291 -178.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 15.5 ttp -68.64 -48.09 64.94 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.72 -175.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 39.2 tp -64.82 -28.95 69.91 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.858 -176.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -62.67 -43.31 99.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.263 0.554 . . . . 0.0 110.107 177.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -75.61 -38.45 59.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.713 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 67.32 28.4 73.67 Favored Glycine 0 CA--C 1.519 0.314 0 CA-C-N 115.857 -0.611 . . . . 0.0 112.776 178.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 17.1 p90 -85.11 176.89 8.12 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.42 ' O ' ' HD3' ' A' ' 56' ' ' PRO . 19.7 ptp180 -59.17 136.29 57.91 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 -179.331 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.5 p -72.62 107.15 2.73 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-O 120.615 0.245 . . . . 0.0 111.57 -177.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.42 ' HD3' ' O ' ' A' ' 54' ' ' ARG . 48.7 Cg_endo -67.45 -18.47 49.36 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 122.585 2.19 . . . . 0.0 111.927 -176.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.575 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -69.78 -15.67 63.16 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.553 -179.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.84 -30.63 71.64 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.984 0.421 . . . . 0.0 110.197 176.011 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.539 ' HG3' ' CD2' ' A' ' 60' ' ' HIS . 23.5 ptp -110.04 -2.83 16.81 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.334 -178.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.539 ' CD2' ' HG3' ' A' ' 59' ' ' MET . 91.1 m-70 -143.11 118.18 10.07 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.613 0.244 . . . . 0.0 110.745 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 55.7 m . . . . . 0 C--O 1.254 1.325 0 CA-C-O 118.407 -0.806 . . . . 0.0 109.647 177.307 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 . . . . . 0 N--CA 1.484 1.236 0 CA-C-O 120.537 0.208 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -138.24 91.38 2.55 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.4 0.619 . . . . 0.0 110.803 -177.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.9 m -115.49 79.15 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.157 176.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.3 m -67.18 -31.88 72.6 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.082 -177.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -71.47 88.67 0.92 Allowed 'General case' 0 C--O 1.237 0.403 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 173.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -61.56 150.71 35.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.733 -169.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -96.34 151.94 19.06 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.4 174.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.433 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 40.7 t -96.76 107.64 38.11 Favored Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 110.224 -0.287 . . . . 0.0 110.224 177.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.15 -16.01 28.61 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.165 1.91 . . . . 0.0 111.447 178.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.433 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 17.2 mm -64.01 -27.2 42.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.746 -179.189 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.435 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 23.3 p -157.57 16.96 0.26 Allowed 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.345 -178.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 88.9 mt 55.89 29.26 13.84 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.053 0.541 . . . . 0.0 112.351 178.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.435 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 35.2 mm-40 -105.98 174.88 5.69 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.152 0.501 . . . . 0.0 111.933 -178.141 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -71.84 148.51 46.12 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.099 -0.955 . . . . 0.0 112.48 -174.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.405 HD11 ' HA ' ' A' ' 40' ' ' LEU . 6.2 mt -149.19 149.1 15.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 123.695 0.798 . . . . 0.0 109.04 174.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 45.1 m-70 -120.93 150.1 41.61 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 110.0 -0.371 . . . . 0.0 110.0 179.04 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.6 m -63.52 -17.4 62.75 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.25 -0.432 . . . . 0.0 112.078 -174.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.4 m -66.21 111.4 3.43 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.931 0.396 . . . . 0.0 110.932 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.473 ' HG2' HD21 ' A' ' 39' ' ' LEU . 64.8 mtm180 -72.82 -9.4 58.63 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.291 -176.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.9 p -71.32 -32.5 47.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.234 178.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.4 p -94.13 -36.35 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 CA-C-O 120.764 0.316 . . . . 0.0 111.227 -177.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -101.69 144.25 30.63 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.579 -178.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -72.31 131.77 43.13 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.405 ' HA ' HD23 ' A' ' 39' ' ' LEU . 7.3 p -93.46 124.55 45.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.065 0.459 . . . . 0.0 111.662 -175.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.706 HD12 ' HB2' ' A' ' 38' ' ' HIS . 55.0 mt -81.23 152.84 71.37 Favored Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.624 173.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -71.59 -2.59 11.58 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.734 2.289 . . . . 0.0 112.096 -178.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 46.6 t -104.04 9.27 36.54 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.068 176.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.3 23.14 49.24 Favored Glycine 0 C--N 1.336 0.563 0 CA-C-N 116.073 -0.512 . . . . 0.0 113.445 172.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.706 ' HB2' HD12 ' A' ' 34' ' ' LEU . 50.9 m-70 -104.19 156.01 18.25 Favored 'General case' 0 C--N 1.328 -0.335 0 O-C-N 122.538 -0.39 . . . . 0.0 111.239 177.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.473 HD21 ' HG2' ' A' ' 28' ' ' ARG . 60.7 mt -117.35 141.13 48.69 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.318 174.476 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.581 HD21 HD11 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -157.48 146.57 19.84 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.303 175.225 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.467 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -60.15 159.69 9.31 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.814 0.34 . . . . 0.0 111.071 179.794 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.447 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 21.7 mmt180 -47.37 -55.54 8.67 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.072 -0.967 . . . . 0.0 112.684 -168.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.41 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 60.5 m -65.71 -48.08 73.2 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 120.742 0.306 . . . . 0.0 111.149 -177.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.467 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -56.39 -28.2 58.53 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.164 -178.202 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.541 ' HB2' HD13 ' A' ' 40' ' ' LEU . 60.5 t80 -59.32 -53.04 62.76 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.263 0.554 . . . . 0.0 109.935 174.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -65.1 -36.47 84.42 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.673 -176.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 43' ' ' THR . 42.0 mt-10 -61.82 -54.92 35.58 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.816 -179.144 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 25.6 ttp -64.32 -44.76 90.53 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.962 0.41 . . . . 0.0 110.284 -178.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 55.9 tp -63.69 -34.79 78.63 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.829 -178.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.8 ttpp -60.49 -46.53 89.78 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.098 0.475 . . . . 0.0 109.99 177.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -66.79 -35.1 79.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.079 177.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 62.2 33.78 87.02 Favored Glycine 0 C--N 1.333 0.402 0 CA-C-N 115.626 -0.716 . . . . 0.0 112.866 176.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -96.75 176.1 6.12 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.631 0.216 . . . . 0.0 110.452 179.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.8 mtm180 -58.28 123.11 14.95 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.904 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.4 p -53.91 108.28 1.08 Allowed Pre-proline 0 CA--C 1.533 0.299 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.804 -179.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.06 -16.85 57.23 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 122.89 2.393 . . . . 0.0 112.859 -174.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.58 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.8 mp -70.45 -16.82 62.97 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 121.054 0.454 . . . . 0.0 110.315 178.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -74.69 -20.2 59.95 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.226 173.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.573 ' N ' ' SD ' ' A' ' 59' ' ' MET . 1.1 mpt? -94.81 -47.81 6.3 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.26 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -142.15 115.05 8.68 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.765 -177.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 12.9 t . . . . . 0 C--O 1.25 1.116 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 176.614 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 . . . . . 0 N--CA 1.48 1.059 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 69.44 89.2 0.1 Allowed 'General case' 0 N--CA 1.466 0.336 0 O-C-N 123.857 0.723 . . . . 0.0 110.413 -178.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 30.4 m -127.1 129.42 71.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.326 179.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.4 m -73.27 145.99 45.71 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.155 177.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -53.65 -48.81 69.05 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 173.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 56.2 tp60 -142.44 141.98 32.28 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.563 -1.198 . . . . 0.0 108.268 168.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -96.87 136.7 37.05 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.801 0.334 . . . . 0.0 110.475 -178.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.5 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 18.2 t -87.08 110.03 29.82 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.077 171.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -74.85 -18.45 19.12 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.508 2.139 . . . . 0.0 110.896 176.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.5 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 15.9 mm -61.7 -25.56 37.29 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.377 -175.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.467 ' SG ' ' HG3' ' A' ' 22' ' ' GLU . 18.3 p -164.81 18.22 0.05 Allowed 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.266 -177.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 80.6 mt 49.91 83.68 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.21 0.529 . . . . 0.0 111.642 -175.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.467 ' HG3' ' SG ' ' A' ' 20' ' ' CYS . 35.3 mt-10 -144.95 155.7 43.56 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.811 176.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -71.91 141.31 49.51 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 123.693 0.621 . . . . 0.0 110.512 175.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 10.0 mt -136.32 136.47 48.98 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.604 176.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.487 ' HD2' ' HB2' ' A' ' 27' ' ' SER . 2.2 p-80 -113.88 145.33 41.62 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.138 177.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.8 m -59.28 -15.91 18.52 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -173.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.487 ' HB2' ' HD2' ' A' ' 25' ' ' HIS . 14.8 m -45.47 108.52 0.13 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.288 0.566 . . . . 0.0 111.049 177.778 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -69.63 -30.01 67.63 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.532 -165.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 45.8 t -76.28 -19.71 15.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.888 0.375 . . . . 0.0 111.211 -174.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 94.3 t -99.8 -46.62 12.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.09 -179.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.35 113.37 23.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.197 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -65.97 138.14 57.62 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.972 -178.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.3 p -93.8 131.53 40.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.271 0.558 . . . . 0.0 111.997 -176.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.676 HD12 ' HB2' ' A' ' 38' ' ' HIS . 60.4 mt -81.79 146.36 56.09 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.302 169.6 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -55.9 -20.85 30.98 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 122.591 2.194 . . . . 0.0 112.107 177.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.3 t -92.54 10.3 30.86 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.646 -177.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.59 17.91 59.4 Favored Glycine 0 C--N 1.337 0.61 0 N-CA-C 114.372 0.509 . . . . 0.0 114.372 170.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.676 ' HB2' HD12 ' A' ' 34' ' ' LEU . 47.3 m-70 -103.37 157.33 17.1 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 117.489 0.645 . . . . 0.0 110.671 177.673 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 91.6 mt -113.45 140.0 48.46 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.878 0.371 . . . . 0.0 110.881 177.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.512 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -152.33 159.18 43.5 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.733 176.476 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.459 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -71.95 168.83 17.17 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.65 0.262 . . . . 0.0 111.066 179.527 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 25.4 mmt180 -44.31 -62.26 1.23 Allowed 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.158 -0.928 . . . . 0.0 112.005 -174.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.6 m -64.77 -49.43 70.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.381 -175.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.459 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -56.47 -27.06 55.94 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.921 -0.581 . . . . 0.0 112.072 -176.003 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.512 ' HB2' HD13 ' A' ' 40' ' ' LEU . 42.4 t80 -58.18 -51.18 70.82 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.691 0.757 . . . . 0.0 109.64 173.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -71.81 -39.1 70.08 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.446 -1.252 . . . . 0.0 110.642 -176.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.48 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 42.5 mt-10 -57.7 -56.41 22.34 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.627 179.008 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 19.8 ttp -63.25 -45.11 93.07 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.127 -176.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 29.0 tp -66.45 -31.24 71.87 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.934 -176.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.3 ttpp -68.8 -48.27 64.04 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.121 178.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 6.2 mm-40 -64.76 -36.38 84.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.067 178.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.13 29.82 68.29 Favored Glycine 0 C--N 1.332 0.339 0 CA-C-N 115.604 -0.726 . . . . 0.0 113.626 173.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.431 ' CD1' ' HB2' ' A' ' 51' ' ' GLU . 39.0 p90 -89.18 169.81 11.14 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 117.045 0.423 . . . . 0.0 110.639 178.202 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 55.6 mtp180 -63.79 125.86 25.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.62 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -55.68 108.8 1.29 Allowed Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.838 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -65.61 -17.44 56.92 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 122.852 2.368 . . . . 0.0 112.389 -177.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.601 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -72.47 -8.43 55.03 Favored 'General case' 0 CA--C 1.528 0.112 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.545 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.98 -24.04 61.52 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.837 0.351 . . . . 0.0 110.563 177.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 14.7 tmm? -71.15 -28.08 64.01 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.222 176.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -65.75 156.2 33.82 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.815 -178.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.4 t . . . . . 0 C--O 1.252 1.21 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 177.618 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 . . . . . 0 N--CA 1.48 1.034 0 CA-C-O 120.786 0.327 . . . . 0.0 110.345 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -110.1 30.67 6.52 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.428 0.632 . . . . 0.0 110.004 175.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 47.9 t -71.92 82.95 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.202 -178.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 17.0 m -84.18 -17.3 40.39 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.56 0.695 . . . . 0.0 109.473 177.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 21.6 mp0 -78.97 99.56 6.89 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.085 -178.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.423 ' O ' ' HB ' ' A' ' 24' ' ' ILE . 29.9 tt0 -60.56 113.07 2.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.55 176.25 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.406 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 33.4 p30 -76.87 152.08 35.57 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.522 0.677 . . . . 0.0 111.565 -173.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 10.5 t -87.79 108.46 20.86 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.481 172.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.406 ' HD3' ' O ' ' A' ' 16' ' ' ASN . 22.4 Cg_exo -63.54 -28.89 70.39 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.407 2.071 . . . . 0.0 111.26 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 8.5 mm -57.14 -23.09 17.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.759 -173.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.4 p -158.08 14.76 0.21 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 120.702 0.287 . . . . 0.0 110.937 178.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 90.3 mt 45.9 67.55 0.73 Allowed 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.543 0.687 . . . . 0.0 111.618 -176.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -136.06 -177.92 4.91 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 114.986 -1.006 . . . . 0.0 109.971 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -77.54 151.93 34.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.882 0.372 . . . . 0.0 111.641 -177.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.474 HD11 ' HA ' ' A' ' 40' ' ' LEU . 2.9 mt -147.72 146.08 18.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.274 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.333 172.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.413 ' CG ' ' H ' ' A' ' 26' ' ' THR . 3.5 t-160 -127.69 -178.66 4.57 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.448 0.166 . . . . 0.0 110.762 -177.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.413 ' H ' ' CG ' ' A' ' 25' ' ' HIS . 6.3 m -72.61 -33.2 66.53 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -167.195 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.5 t -59.08 117.59 4.88 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 120.894 0.378 . . . . 0.0 112.002 -171.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.557 ' HG3' HD21 ' A' ' 39' ' ' LEU . 6.8 mpt_? -76.8 -6.9 54.18 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.897 176.511 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.5 t -87.17 -35.02 7.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.698 178.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.1 t -81.4 -55.26 8.39 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.883 176.447 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -94.66 125.38 39.27 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.697 177.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -67.89 133.03 48.44 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 -178.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.7 p -87.57 116.62 30.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-O 121.106 0.479 . . . . 0.0 111.008 179.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.567 HD12 ' HB2' ' A' ' 38' ' ' HIS . 73.3 mt -65.7 155.42 86.14 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.462 175.396 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.26 -14.76 25.73 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.791 2.327 . . . . 0.0 112.423 178.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 48.9 t -101.57 11.02 39.7 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.78 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 83.45 22.22 56.87 Favored Glycine 0 C--N 1.335 0.511 0 CA-C-N 116.224 -0.444 . . . . 0.0 114.153 171.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.626 ' HB3' HD22 ' A' ' 57' ' ' LEU . 48.7 m-70 -103.01 156.66 17.52 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 117.281 0.54 . . . . 0.0 110.909 177.406 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.557 HD21 ' HG3' ' A' ' 28' ' ' ARG . 80.4 mt -113.11 141.25 47.13 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.865 0.364 . . . . 0.0 110.79 177.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.545 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -157.85 150.15 22.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.949 175.263 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.49 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -64.64 165.33 10.42 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.703 0.287 . . . . 0.0 111.433 179.339 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.457 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 10.0 mmm180 -48.88 -66.26 0.43 Allowed 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.121 -0.945 . . . . 0.0 112.876 -171.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 48.1 m -58.06 -40.89 82.14 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.962 0.41 . . . . 0.0 110.842 -175.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.49 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.5 OUTLIER -65.94 -29.57 70.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.81 179.755 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.545 ' HB2' HD13 ' A' ' 40' ' ' LEU . 20.8 t80 -63.46 -55.6 22.88 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.394 178.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -59.24 -49.4 77.98 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.967 -175.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.428 ' HA ' ' HD3' ' A' ' 50' ' ' LYS . 7.3 mm-40 -57.19 -43.34 82.61 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.988 -178.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.436 ' C ' ' SD ' ' A' ' 48' ' ' MET . 0.7 OUTLIER -68.72 -44.48 73.79 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 121.069 0.462 . . . . 0.0 110.358 178.898 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.484 ' O ' HD13 ' A' ' 49' ' ' LEU . 2.3 tm? -66.2 -33.66 76.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.625 -174.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 46.6 mtpt -59.15 -34.36 71.99 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.968 178.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.421 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 42.6 mt-10 -96.15 -38.72 10.04 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.983 -177.438 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 65.12 26.95 71.77 Favored Glycine 0 CA--C 1.518 0.261 0 CA-C-N 115.99 -0.55 . . . . 0.0 112.375 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.421 ' HD1' ' HB2' ' A' ' 51' ' ' GLU . 33.7 p90 -70.71 177.92 3.32 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 122.425 0.29 . . . . 0.0 111.166 -177.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.427 ' O ' ' HD3' ' A' ' 56' ' ' PRO . 15.2 mmt180 -56.65 121.57 10.05 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.837 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.2 p -73.46 105.83 1.93 Allowed Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.413 -178.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.427 ' HD3' ' O ' ' A' ' 54' ' ' ARG . 46.4 Cg_endo -66.8 -13.79 41.28 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 122.58 2.187 . . . . 0.0 112.156 -176.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.626 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -73.54 -14.94 61.3 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.296 179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.53 -24.48 67.62 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.459 177.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -71.95 -25.64 61.95 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.783 179.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 17.7 t60 -111.3 142.83 43.01 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.593 -177.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 7.9 p . . . . . 0 C--O 1.253 1.251 0 CA-C-O 118.457 -0.782 . . . . 0.0 110.228 175.419 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 . . . . . 0 N--CA 1.482 1.137 0 N-CA-C 111.357 0.132 . . . . 0.0 111.357 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.9 p-10 -69.1 139.46 54.77 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.974 0.416 . . . . 0.0 111.043 -176.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.411 ' HB ' ' HG2' ' A' ' 14' ' ' GLN . 35.2 m -125.75 148.13 30.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.19 177.316 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.5 t -104.91 21.47 16.95 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.21 0.529 . . . . 0.0 109.969 -179.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.411 ' HG2' ' HB ' ' A' ' 12' ' ' VAL . 13.8 pt20 -118.46 173.74 6.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.349 -178.023 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.506 ' HB2' ' O ' ' A' ' 24' ' ' ILE . 1.7 mp0 -88.2 172.48 9.44 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 172.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 39.9 p30 -150.81 161.48 42.59 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.163 0.506 . . . . 0.0 111.108 -179.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.465 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 44.8 t -108.79 108.16 60.57 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.593 172.377 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -74.01 -14.97 23.59 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.264 1.976 . . . . 0.0 111.469 177.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.465 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 23.3 mm -64.44 -24.13 34.96 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.046 -177.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.0 p -161.16 10.81 0.09 Allowed 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 -177.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 9.3 mp 54.76 94.12 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.314 0.578 . . . . 0.0 110.569 -172.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -160.02 164.35 33.28 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.859 -178.069 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -73.83 137.55 43.87 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.734 -179.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.506 ' O ' ' HB2' ' A' ' 15' ' ' GLN . 5.2 mt -141.12 148.33 21.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 174.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -134.98 166.0 24.04 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.0 m -52.06 -17.03 0.89 Allowed 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 122.994 0.518 . . . . 0.0 112.05 177.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.3 m -48.73 86.79 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.328 0.651 . . . . 0.0 111.882 179.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 50.2 ttp180 -81.1 -4.95 56.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.894 -176.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 47.9 t -80.27 -36.84 16.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.267 0.556 . . . . 0.0 109.741 175.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.2 t -88.65 -54.41 7.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.531 177.37 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.94 117.83 18.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.123 -179.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 48.4 t60 -69.52 127.56 33.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.036 -179.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.9 p -88.45 118.6 34.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.245 0.545 . . . . 0.0 111.284 -177.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.586 HD12 ' HB2' ' A' ' 38' ' ' HIS . 92.7 mt -62.81 150.4 87.4 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.755 172.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -59.05 -12.76 16.52 Favored 'Trans proline' 0 CA--C 1.535 0.537 0 C-N-CA 122.712 2.275 . . . . 0.0 112.953 177.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.3 t -96.91 6.69 48.18 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.77 0.319 . . . . 0.0 110.801 178.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.14 19.99 47.94 Favored Glycine 0 C--N 1.337 0.632 0 N-CA-C 114.286 0.474 . . . . 0.0 114.286 172.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.607 ' HB3' HD22 ' A' ' 57' ' ' LEU . 39.9 m-70 -104.0 156.87 17.51 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 117.505 0.652 . . . . 0.0 110.981 178.01 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.6 mt -113.65 137.07 52.12 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.79 0.328 . . . . 0.0 111.189 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.578 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -157.24 157.5 34.41 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.859 174.661 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.492 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -72.31 166.65 22.04 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.174 -179.693 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.495 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 26.3 mmm180 -49.13 -64.02 0.93 Allowed 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -172.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.489 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 27.2 m -60.56 -41.56 94.82 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.572 0.225 . . . . 0.0 110.628 -175.432 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.492 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -62.34 -27.57 69.15 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 120.884 0.373 . . . . 0.0 110.479 178.535 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.578 ' HB2' HD13 ' A' ' 40' ' ' LEU . 25.0 t80 -70.74 -44.76 66.13 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.933 174.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.41 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 42.7 mt-10 -66.9 -27.9 67.87 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.677 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.489 ' HG3' ' O ' ' A' ' 43' ' ' THR . 43.9 mt-10 -73.21 -51.79 16.46 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.24 175.136 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.446 ' C ' ' SD ' ' A' ' 48' ' ' MET . 0.6 OUTLIER -62.32 -54.27 42.94 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.894 -176.776 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 65.6 tp -61.72 -28.44 69.42 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.095 -177.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.534 ' NZ ' ' HB2' ' A' ' 50' ' ' LYS . 4.6 ttmp? -61.49 -40.63 95.29 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.057 0.456 . . . . 0.0 110.579 178.475 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.423 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 19.8 mm-40 -88.25 -33.12 18.19 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.011 -178.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 61.64 29.95 73.41 Favored Glycine 0 C--N 1.334 0.466 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.307 -178.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.493 ' HB2' ' NH1' ' A' ' 54' ' ' ARG . 16.0 p90 -82.52 174.04 11.43 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 120.806 0.336 . . . . 0.0 111.154 -175.351 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.493 ' NH1' ' HB2' ' A' ' 53' ' ' TYR . 0.3 OUTLIER -57.44 138.79 54.62 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.747 177.939 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.403 ' HA ' ' HD2' ' A' ' 56' ' ' PRO . 0.9 OUTLIER -90.37 107.17 18.08 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -175.353 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 55' ' ' CYS . 33.5 Cg_endo -63.63 -15.0 46.07 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.781 2.321 . . . . 0.0 112.192 179.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.607 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.9 mp -75.38 -6.64 51.01 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.418 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -73.11 -34.86 66.4 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.014 0.435 . . . . 0.0 109.869 173.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 23.5 ttt -73.29 -49.33 28.18 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.299 176.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 80.2 t60 -72.45 139.13 47.55 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.918 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.5 m . . . . . 0 C--O 1.251 1.163 0 CA-C-O 118.614 -0.707 . . . . 0.0 110.148 178.884 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 . . . . . 0 N--CA 1.484 1.249 0 CA-C-O 121.114 0.483 . . . . 0.0 110.586 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.514 ' HA ' HE22 ' A' ' 14' ' ' GLN . 2.4 m-20 -77.2 77.69 3.73 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.764 -178.116 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 54.8 t -73.75 -77.13 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 176.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.7 m -157.55 98.22 1.66 Allowed 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.367 177.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.514 HE22 ' HA ' ' A' ' 11' ' ' ASN . 21.8 mp0 -76.24 136.65 39.68 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.706 175.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.552 ' O ' ' HB ' ' A' ' 24' ' ' ILE . 15.0 mm100 -62.41 111.06 1.86 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.907 0.384 . . . . 0.0 110.72 178.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.401 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 8.4 p30 -80.92 151.03 28.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.778 178.147 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.51 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 22.1 t -82.92 108.78 13.54 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.365 177.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.41 ' HG3' ' HG ' ' A' ' 57' ' ' LEU . 73.3 Cg_endo -74.89 -7.42 19.23 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.269 1.979 . . . . 0.0 111.437 179.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.51 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 21.3 mm -72.3 -22.98 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.41 178.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.679 ' SG ' ' HG3' ' A' ' 22' ' ' GLU . 21.3 p -163.09 22.62 0.09 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 120.726 0.298 . . . . 0.0 111.574 -179.528 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.406 HD12 ' N ' ' A' ' 21' ' ' LEU . 7.1 mp 57.32 25.93 11.79 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 174.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.679 ' HG3' ' SG ' ' A' ' 20' ' ' CYS . 54.0 mt-10 -93.28 -179.42 5.06 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 120.712 0.291 . . . . 0.0 110.62 178.257 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -90.39 149.53 22.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.406 177.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.552 ' HB ' ' O ' ' A' ' 15' ' ' GLN . 6.4 mt -137.08 137.19 46.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 175.497 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 18.3 t60 -111.82 156.47 21.93 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 -177.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.5 t -56.7 -16.96 7.3 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -177.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.0 t -61.65 93.88 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.137 0.494 . . . . 0.0 110.839 -178.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 50.0 ttp180 -76.61 -14.32 60.0 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.625 -178.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.8 p -68.57 -19.03 23.87 Favored 'Isoleucine or valine' 0 C--O 1.238 0.447 0 CA-C-O 121.473 0.654 . . . . 0.0 109.495 173.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 61.2 t -99.09 -63.14 1.72 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.533 173.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.77 123.05 21.77 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.21 -178.017 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -76.17 140.31 41.67 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.804 178.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.404 ' HA ' ' O ' ' A' ' 38' ' ' HIS . 7.5 p -98.05 120.13 46.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-O 121.183 0.516 . . . . 0.0 111.308 -179.421 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.628 HD12 ' HB2' ' A' ' 38' ' ' HIS . 84.6 mt -61.27 148.65 84.88 Favored Pre-proline 0 C--O 1.233 0.215 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.022 172.742 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -56.8 -19.68 32.27 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.595 2.197 . . . . 0.0 112.45 179.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 46.7 t -88.98 0.35 56.73 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.975 -178.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.35 19.33 28.24 Favored Glycine 0 C--N 1.335 0.502 0 C-N-CA 121.41 -0.424 . . . . 0.0 114.084 174.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.628 ' HB2' HD12 ' A' ' 34' ' ' LEU . 54.6 m-70 -103.32 156.62 17.6 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 117.424 0.612 . . . . 0.0 111.241 179.412 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.0 mt -112.98 139.8 48.33 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 120.848 0.356 . . . . 0.0 111.445 178.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.563 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -162.86 149.04 12.37 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.579 176.178 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.563 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -58.9 158.43 8.33 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.042 175.547 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.528 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 9.9 mmt85 -50.91 -58.24 6.5 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 115.729 -0.668 . . . . 0.0 112.241 -170.316 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.444 ' O ' ' HG2' ' A' ' 47' ' ' GLU . 26.6 m -55.84 -44.25 77.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.238 -177.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.563 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -62.44 -31.9 72.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.764 179.267 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.563 ' HB2' HD13 ' A' ' 40' ' ' LEU . 34.5 t80 -62.34 -47.67 83.19 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.845 175.554 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -62.35 -51.47 67.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.56 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 43' ' ' THR . 23.0 mm-40 -62.84 -37.18 85.78 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.583 -177.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.453 ' C ' ' SD ' ' A' ' 48' ' ' MET . 0.5 OUTLIER -67.89 -51.36 48.93 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.255 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.4 tp -66.64 -28.42 68.46 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.589 -179.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -57.5 -50.62 72.47 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.371 177.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.418 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 28.5 mm-40 -79.92 -32.73 40.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.46 178.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 61.8 32.86 83.29 Favored Glycine 0 C--N 1.331 0.276 0 CA-C-N 115.91 -0.587 . . . . 0.0 112.46 179.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.418 ' HD1' ' HB2' ' A' ' 51' ' ' GLU . 22.8 p90 -77.66 -175.93 4.1 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.858 0.361 . . . . 0.0 110.727 -179.365 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.528 ' H ' ' HD2' ' A' ' 54' ' ' ARG . 2.4 mpt_? -72.73 122.37 21.39 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -177.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.4 p -61.8 107.3 1.07 Allowed Pre-proline 0 C--N 1.329 -0.323 0 O-C-N 123.102 0.251 . . . . 0.0 111.273 -178.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -59.84 -28.9 88.26 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.748 2.299 . . . . 0.0 112.163 -173.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.574 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.6 mp -62.61 -16.81 58.42 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.952 0.406 . . . . 0.0 110.85 -177.161 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -74.73 -32.99 62.29 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.617 176.608 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 28.1 ttt -109.9 -23.12 11.53 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -174.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.437 ' O ' ' HA ' ' A' ' 57' ' ' LEU . 59.4 t-80 -151.38 151.51 31.83 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -174.311 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 31.6 t . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.178 -0.915 . . . . 0.0 109.29 176.571 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 . . . . . 0 N--CA 1.481 1.105 0 CA-C-O 120.498 0.19 . . . . 0.0 111.13 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -160.07 121.26 3.11 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 179.019 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 10.9 p -96.39 -19.31 6.21 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.198 -179.004 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 41.4 p -64.6 108.92 1.82 Allowed 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.055 0.455 . . . . 0.0 111.445 -176.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -155.45 155.02 32.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.374 175.359 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.476 ' HB2' HG22 ' A' ' 24' ' ' ILE . 83.8 mm-40 -121.85 154.06 37.55 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 -178.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 -112.3 144.29 41.96 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.836 0.35 . . . . 0.0 110.354 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.458 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 43.5 t -92.27 108.19 28.95 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.704 176.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.433 ' HG2' ' HG2' ' A' ' 56' ' ' PRO . 73.6 Cg_endo -76.52 -8.67 18.43 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.246 1.964 . . . . 0.0 111.617 177.135 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.458 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 20.6 mm -70.91 -23.12 23.43 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.943 -177.58 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.471 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 21.4 p -162.18 12.63 0.08 Allowed 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -177.391 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 7.5 mp 54.97 91.02 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.215 0.531 . . . . 0.0 109.92 -171.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.471 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 0.4 OUTLIER -155.37 167.48 30.24 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.361 -174.134 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -88.92 143.32 26.95 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.708 0.29 . . . . 0.0 110.401 179.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.476 HG22 ' HB2' ' A' ' 15' ' ' GLN . 11.4 mt -142.48 142.24 27.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -123.74 177.6 5.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.276 179.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 15.2 t -75.81 -15.82 60.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.593 -173.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.5 m -57.52 89.91 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 120.927 0.394 . . . . 0.0 111.224 179.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.505 ' HG2' HD21 ' A' ' 39' ' ' LEU . 82.8 mtt85 -71.81 -11.48 60.83 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.055 -177.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 66.6 t -66.74 -35.31 74.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.232 0.539 . . . . 0.0 109.994 173.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 40.0 t -94.08 -53.69 8.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.951 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -84.54 116.8 23.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.061 178.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -65.38 124.82 23.26 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.273 -177.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.492 ' HA ' HD23 ' A' ' 39' ' ' LEU . 7.3 p -80.73 116.94 25.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.099 0.476 . . . . 0.0 110.95 178.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.621 HD12 ' HB2' ' A' ' 38' ' ' HIS . 76.2 mt -65.98 154.91 88.42 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.046 174.149 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -67.99 -5.55 14.91 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.323 2.015 . . . . 0.0 111.475 178.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 30.2 t -106.03 14.49 27.76 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.402 178.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.66 2.53 75.69 Favored Glycine 0 C--N 1.341 0.846 0 N-CA-C 114.948 0.739 . . . . 0.0 114.948 169.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.621 ' HB2' HD12 ' A' ' 34' ' ' LEU . 25.9 m-70 -96.95 156.83 16.18 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 117.525 0.662 . . . . 0.0 111.339 -175.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.505 HD21 ' HG2' ' A' ' 28' ' ' ARG . 98.1 mt -114.0 142.57 46.0 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.876 178.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.528 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -157.04 152.12 26.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.862 175.872 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.512 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -66.15 167.82 9.48 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.991 178.761 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.509 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 15.4 mmm180 -50.17 -60.45 2.95 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.174 -169.233 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 28.3 m -66.22 -41.43 90.09 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.247 -175.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.512 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -60.8 -26.38 67.25 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 120.77 0.319 . . . . 0.0 110.694 -178.941 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.528 ' HB2' HD13 ' A' ' 40' ' ' LEU . 39.5 t80 -59.67 -48.84 80.1 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.008 174.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -65.82 -44.31 85.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.629 -179.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -57.8 -51.69 68.52 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.925 -178.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 9.5 tmm? -65.0 -49.39 70.43 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.19 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 54.1 tp -62.12 -31.1 71.53 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.103 -177.266 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.4 ttmm -63.58 -40.44 96.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.918 0.389 . . . . 0.0 110.272 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -75.62 -41.4 54.41 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.363 176.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.87 45.92 94.32 Favored Glycine 0 C--N 1.333 0.388 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 -176.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -102.91 -175.71 2.89 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.784 0.325 . . . . 0.0 110.513 -175.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.454 ' HG3' ' O ' ' A' ' 54' ' ' ARG . 34.8 ptt180 -56.78 110.6 0.83 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.296 177.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.422 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 0.8 OUTLIER -64.81 105.48 0.74 Allowed Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.731 -0.213 . . . . 0.0 110.646 178.936 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.433 ' HG2' ' HG2' ' A' ' 18' ' ' PRO . 22.3 Cg_endo -59.49 -22.51 66.66 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 122.806 2.337 . . . . 0.0 112.408 -172.493 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.561 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.3 mp -66.93 -20.55 65.92 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.518 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.7 OUTLIER -64.2 -42.6 96.56 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.096 174.606 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 66.8 mtt -92.32 -3.94 54.65 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.207 177.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 62.5 m80 65.86 14.41 9.55 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.876 -178.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.3 p . . . . . 0 C--O 1.251 1.147 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.612 -177.209 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 . . . . . 0 N--CA 1.48 1.055 0 CA-C-O 120.759 0.314 . . . . 0.0 110.316 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -113.51 110.33 20.1 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.895 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 34.3 m -108.5 0.67 9.7 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.024 -177.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 42.0 t -75.07 -25.94 58.98 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.098 -177.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -109.01 172.36 6.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.883 -175.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.512 ' O ' ' HB ' ' A' ' 24' ' ' ILE . 24.5 mm-40 -87.06 98.8 11.48 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 175.02 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.464 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 12.9 m120 -80.05 141.98 35.35 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.078 -174.223 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.457 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 44.1 t -80.4 109.41 12.66 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.497 175.251 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.528 ' HG2' ' HG2' ' A' ' 56' ' ' PRO . 92.5 Cg_endo -80.86 -4.92 12.96 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.454 2.103 . . . . 0.0 111.665 177.22 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.457 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 19.0 mm -72.96 -20.29 18.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.705 -178.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.717 ' SG ' ' HB2' ' A' ' 22' ' ' GLU . 21.2 p -163.61 17.69 0.07 Allowed 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.243 -179.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.452 ' N ' HD12 ' A' ' 21' ' ' LEU . 6.4 mp 49.08 80.0 0.07 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.164 0.506 . . . . 0.0 109.969 -174.052 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.717 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 0.5 OUTLIER -150.24 170.67 18.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.66 -173.078 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -82.93 137.49 34.19 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 122.889 0.475 . . . . 0.0 111.406 -177.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.512 ' HB ' ' O ' ' A' ' 15' ' ' GLN . 26.6 mt -136.72 131.32 47.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 109.641 -0.504 . . . . 0.0 109.641 171.469 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 66.7 m170 -117.37 178.73 4.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.588 178.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.9 t -65.46 -17.31 64.45 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -174.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 67.7 m -60.12 94.52 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.055 0.455 . . . . 0.0 111.562 -178.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.6 mtt85 -80.45 17.29 1.11 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.667 -178.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.6 t -88.94 -51.8 11.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.122 0.487 . . . . 0.0 109.705 173.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 57.6 t -84.32 -38.18 13.49 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.977 177.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.451 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -82.19 97.65 8.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.801 175.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.402 ' O ' HD12 ' A' ' 40' ' ' LEU . 9.3 t60 -61.11 136.48 58.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.912 -178.547 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.7 p -89.76 124.69 42.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.213 0.53 . . . . 0.0 111.222 -177.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.657 HD12 ' HB2' ' A' ' 38' ' ' HIS . 60.5 mt -76.27 151.85 83.65 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.408 174.515 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.5 -22.5 35.01 Favored 'Trans proline' 0 CA--C 1.535 0.531 0 C-N-CA 122.58 2.186 . . . . 0.0 112.295 175.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.2 t -95.46 12.8 28.1 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.853 -177.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 83.8 15.6 70.01 Favored Glycine 0 C--N 1.337 0.627 0 N-CA-C 114.5 0.56 . . . . 0.0 114.5 170.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.657 ' HB2' HD12 ' A' ' 34' ' ' LEU . 59.3 m-70 -100.01 156.62 17.06 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 117.555 0.678 . . . . 0.0 110.619 178.044 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.451 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 97.1 mt -112.66 142.5 45.19 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.674 176.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.537 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -159.27 140.79 13.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.784 175.006 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.513 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -54.18 155.42 3.68 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.648 0.261 . . . . 0.0 111.413 179.115 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.512 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 55.1 mmm-85 -36.35 -66.57 0.21 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.26 1.024 . . . . 0.0 113.284 -173.265 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 30.8 m -64.53 -36.58 84.65 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.762 0.315 . . . . 0.0 111.486 -172.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.513 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -64.14 -28.54 69.83 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.736 -178.942 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.537 ' HB2' HD13 ' A' ' 40' ' ' LEU . 32.3 t80 -58.49 -50.03 75.22 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.818 175.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -66.63 -41.61 88.04 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.232 -178.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.417 ' O ' ' HB3' ' A' ' 50' ' ' LYS . 19.2 mm-40 -56.58 -54.99 39.58 Favored 'General case' 0 C--O 1.235 0.335 0 O-C-N 123.332 0.395 . . . . 0.0 111.724 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 14.7 ttp -61.67 -49.67 75.57 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.141 0.496 . . . . 0.0 110.338 -178.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 32.0 tp -64.7 -28.61 69.72 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.539 -178.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.417 ' HB3' ' O ' ' A' ' 47' ' ' GLU . 34.7 ttpt -63.61 -47.85 79.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.405 177.357 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.402 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 51.4 mt-10 -75.4 -26.95 58.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.75 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 62.9 25.97 68.38 Favored Glycine 0 C--N 1.331 0.304 0 CA-C-N 115.956 -0.565 . . . . 0.0 113.27 175.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.402 ' HD1' ' HB2' ' A' ' 51' ' ' GLU . 20.0 p90 -83.71 176.12 9.19 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 178.588 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 32.3 mtp180 -70.3 130.6 42.42 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 -176.314 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 58' ' ' CYS . 1.5 p -60.37 107.4 1.03 Allowed Pre-proline 0 CA--C 1.532 0.258 0 CA-C-O 120.663 0.268 . . . . 0.0 111.553 -178.542 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.528 ' HG2' ' HG2' ' A' ' 18' ' ' PRO . 39.5 Cg_endo -66.19 -18.21 55.7 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.757 2.304 . . . . 0.0 112.32 -175.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.589 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -69.88 -13.25 62.16 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 120.937 0.399 . . . . 0.0 110.182 179.247 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 55' ' ' CYS . 0.8 OUTLIER -74.04 -22.8 59.41 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.319 173.262 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 27.3 ttt -83.5 -49.46 9.24 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 178.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 13.5 p-80 -171.22 162.27 6.86 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.466 171.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 52.0 p . . . . . 0 C--O 1.25 1.12 0 CA-C-O 118.393 -0.813 . . . . 0.0 109.828 179.432 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.864 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -78.26 92.59 4.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.477 0.656 . . . . 0.0 110.587 -179.182 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 17.2 m -98.15 108.82 22.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.822 175.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 62.7 m -70.38 80.63 0.55 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.408 0.623 . . . . 0.0 111.357 -176.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 80.0 mm-40 -111.22 153.51 25.74 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.012 173.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.434 ' HB2' ' O ' ' A' ' 24' ' ' ILE . 15.7 mm-40 -69.04 87.69 0.39 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.361 0.601 . . . . 0.0 110.183 -177.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 -90.12 141.41 28.71 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.624 -179.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.413 ' HB2' HG13 ' A' ' 24' ' ' ILE . 33.4 t -72.6 110.07 7.41 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.759 177.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.571 ' HG2' ' HG ' ' A' ' 57' ' ' LEU . 15.6 Cg_exo -67.62 -19.94 47.51 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.464 2.109 . . . . 0.0 111.373 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.453 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 10.4 mm -70.04 -18.39 21.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.387 -174.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.57 ' SG ' ' HG3' ' A' ' 22' ' ' GLU . 19.1 p -167.87 21.95 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 121.047 -0.261 . . . . 0.0 111.689 -178.331 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 89.3 mt 55.98 28.69 13.07 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.57 ' HG3' ' SG ' ' A' ' 20' ' ' CYS . 39.0 mt-10 -91.54 -177.73 4.89 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 177.072 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -91.94 151.56 20.46 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.889 0.376 . . . . 0.0 110.475 175.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.434 ' O ' ' HB2' ' A' ' 15' ' ' GLN . 15.2 mt -143.05 111.98 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 173.06 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 35.4 t60 -89.88 150.91 22.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.178 -177.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 12.9 m -53.36 -25.46 15.38 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.085 -177.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.8 p -64.74 89.47 0.07 Allowed 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.09 0.471 . . . . 0.0 110.367 177.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.2 ppt_? -78.22 18.96 0.47 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.997 -175.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.8 p -73.05 -30.95 33.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-O 121.206 0.527 . . . . 0.0 109.687 172.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.0 p -101.62 -38.55 6.01 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.436 177.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -82.6 111.11 18.28 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.51 179.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -64.82 133.52 52.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.117 -179.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.3 p -92.1 122.14 43.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.082 0.468 . . . . 0.0 111.131 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.594 HD12 ' HB2' ' A' ' 38' ' ' HIS . 82.7 mt -67.81 155.08 92.42 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.639 172.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.41 -12.82 35.02 Favored 'Trans proline' 0 CA--C 1.531 0.357 0 C-N-CA 122.102 1.868 . . . . 0.0 111.736 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 38.4 t -100.74 13.69 34.07 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.593 -179.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.19 17.34 65.03 Favored Glycine 0 C--N 1.336 0.578 0 N-CA-C 114.458 0.543 . . . . 0.0 114.458 169.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.604 ' HB3' HD22 ' A' ' 57' ' ' LEU . 41.9 m-70 -103.27 156.11 17.96 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 117.53 0.665 . . . . 0.0 110.421 177.426 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.5 mt -112.01 144.6 41.09 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.849 0.357 . . . . 0.0 111.252 -179.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.543 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -163.31 151.47 13.62 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.301 175.551 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.554 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -69.83 163.28 26.2 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.886 178.165 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.481 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 57.3 mmm-85 -48.53 -57.67 5.81 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 123.822 0.701 . . . . 0.0 112.183 -174.576 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 42.8 p -52.73 -57.04 11.4 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.423 0.63 . . . . 0.0 110.599 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.554 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.5 OUTLIER -58.15 -26.67 62.99 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.111 -0.95 . . . . 0.0 111.679 -179.971 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.543 ' HB2' HD13 ' A' ' 40' ' ' LEU . 39.6 t80 -66.71 -48.98 67.51 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 177.427 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -63.98 -43.57 95.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.455 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -57.2 -53.05 62.46 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.138 178.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.431 ' C ' ' SD ' ' A' ' 48' ' ' MET . 1.0 OUTLIER -65.61 -50.87 63.47 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.618 -177.063 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 42.8 tp -62.85 -30.28 71.38 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.715 -177.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 45.8 tttm -62.1 -51.48 67.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.127 0.489 . . . . 0.0 110.214 175.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.438 ' HB2' ' HD1' ' A' ' 53' ' ' TYR . 11.0 mm-40 -67.25 -35.44 79.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.641 -177.102 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 63.34 24.48 67.51 Favored Glycine 0 CA--C 1.519 0.32 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.937 176.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.438 ' HD1' ' HB2' ' A' ' 51' ' ' GLU . 14.8 p90 -79.77 163.4 24.49 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.58 ' H ' ' HD3' ' A' ' 54' ' ' ARG . 0.8 OUTLIER -61.07 130.33 45.8 Favored 'General case' 0 C--N 1.332 -0.152 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 -179.496 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.2 p -64.65 114.06 13.11 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.148 -174.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -67.96 -24.8 39.1 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.735 2.29 . . . . 0.0 111.879 -178.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.604 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.0 mp -65.25 -15.79 62.86 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.62 -178.313 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.83 -21.59 66.82 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.871 0.367 . . . . 0.0 110.676 175.022 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.1 mpp? -110.44 14.23 22.61 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.425 175.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.424 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 57.1 t-80 -139.77 93.05 2.61 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 -178.378 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 34.9 m . . . . . 0 C--O 1.251 1.143 0 CA-C-O 118.856 -0.592 . . . . 0.0 109.778 -178.639 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 . . . . . 0 N--CA 1.479 1.009 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 50.9 m-80 -59.64 88.46 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.007 0.432 . . . . 0.0 111.296 -178.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 45.4 t -129.5 101.39 6.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 174.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.0 m -64.92 100.22 0.4 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.297 -176.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -157.8 133.85 9.38 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.76 179.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.42 ' HA ' ' OE1' ' A' ' 15' ' ' GLN . 14.4 mm-40 -92.65 97.63 10.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.189 0.519 . . . . 0.0 110.214 -179.486 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 -96.62 138.25 34.47 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.396 179.265 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.533 ' SG ' ' HB ' ' A' ' 19' ' ' ILE . 18.8 t -78.31 111.05 15.94 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.267 179.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -72.87 -12.98 26.55 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.214 1.943 . . . . 0.0 111.677 177.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.533 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 24.4 mm -71.35 -19.23 20.66 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.155 -178.07 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.6 p -168.31 20.5 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 120.962 -0.295 . . . . 0.0 111.775 -179.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.447 HD12 ' N ' ' A' ' 21' ' ' LEU . 6.3 mp 48.26 72.72 0.25 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.009 0.433 . . . . 0.0 110.716 -177.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -146.64 -176.62 5.26 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.379 -173.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -78.12 139.29 39.02 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.086 -176.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.457 HD13 ' O ' ' A' ' 39' ' ' LEU . 11.9 mt -145.43 140.31 22.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.288 169.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 22.8 m80 -145.46 173.47 11.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.635 0.255 . . . . 0.0 110.605 176.09 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 63.2 m -60.0 -24.64 64.62 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.802 -0.636 . . . . 0.0 112.691 -173.305 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -55.4 98.69 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.186 0.517 . . . . 0.0 110.853 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.49 -25.19 66.58 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.714 -174.693 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.471 HG13 HG23 ' A' ' 30' ' ' VAL . 13.6 p -58.27 -31.27 42.01 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-O 121.084 0.469 . . . . 0.0 110.162 179.231 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.471 HG23 HG13 ' A' ' 29' ' ' VAL . 73.0 t -96.61 -49.47 12.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.008 177.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.575 ' HB1' ' HB3' ' A' ' 39' ' ' LEU . . . -94.59 103.79 15.74 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.088 -177.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -66.56 139.37 57.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.855 178.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 52.4 t -87.19 120.85 37.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-O 120.735 0.302 . . . . 0.0 111.279 -178.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.583 HD12 ' HB2' ' A' ' 38' ' ' HIS . 55.2 mt -73.45 152.82 89.92 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.331 172.749 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -64.11 1.15 1.69 Allowed 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 123.241 2.627 . . . . 0.0 113.583 -178.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 47.7 t -115.7 4.26 14.03 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.781 0.325 . . . . 0.0 110.818 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.48 24.23 26.72 Favored Glycine 0 C--N 1.335 0.505 0 C-N-CA 121.219 -0.515 . . . . 0.0 113.987 173.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.583 ' HB2' HD12 ' A' ' 34' ' ' LEU . 69.1 m-70 -103.48 155.52 18.45 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 117.115 0.457 . . . . 0.0 110.669 174.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.575 ' HB3' ' HB1' ' A' ' 31' ' ' ALA . 88.8 mt -113.01 142.68 45.43 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.451 177.333 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.544 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -158.04 140.4 14.39 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.759 174.362 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.564 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -55.55 156.2 4.87 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.865 0.364 . . . . 0.0 111.096 -179.653 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.567 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 8.6 mmm180 -43.75 -59.81 2.07 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 114.857 -1.065 . . . . 0.0 113.098 -168.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 18.5 m -67.24 -37.65 83.9 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.605 0.241 . . . . 0.0 111.442 -174.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.564 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -62.19 -27.41 68.95 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.904 0.383 . . . . 0.0 110.289 179.243 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.567 ' HB3' ' O ' ' A' ' 42' ' ' ARG . 41.8 t80 -60.85 -47.45 86.32 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.103 175.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -60.85 -45.87 92.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.409 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.472 ' HA ' ' HE2' ' A' ' 50' ' ' LYS . 11.7 mm-40 -63.6 -40.02 95.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.849 -177.142 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.429 ' C ' ' SD ' ' A' ' 48' ' ' MET . 8.5 tmm? -72.64 -51.2 20.55 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.147 0.498 . . . . 0.0 109.708 179.826 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 59.8 tp -60.29 -27.69 67.49 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.617 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.472 ' HE2' ' HA ' ' A' ' 47' ' ' GLU . 17.3 ttmm -49.64 -38.73 33.49 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.226 177.018 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.8 mm-40 -93.73 -38.76 11.13 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.942 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 63.02 20.73 62.86 Favored Glycine 0 C--N 1.333 0.391 0 C-N-CA 121.14 -0.552 . . . . 0.0 112.418 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -71.14 -173.7 0.88 Allowed 'General case' 0 C--O 1.237 0.419 0 CA-C-O 120.88 0.371 . . . . 0.0 111.576 -178.567 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.49 136.32 58.01 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 175.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.447 ' HA ' ' HD2' ' A' ' 56' ' ' PRO . 0.8 OUTLIER -80.99 108.53 10.45 Favored Pre-proline 0 C--N 1.323 -0.562 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -172.253 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.447 ' HD2' ' HA ' ' A' ' 55' ' ' CYS . 27.5 Cg_endo -61.45 -20.95 70.52 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.468 2.112 . . . . 0.0 112.084 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.547 HD22 ' HB3' ' A' ' 38' ' ' HIS . 5.1 mp -70.86 -12.08 61.33 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.724 -178.332 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -64.43 -12.99 48.96 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.234 0.54 . . . . 0.0 110.264 176.241 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.406 ' C ' ' SD ' ' A' ' 59' ' ' MET . 1.2 tmt? -80.75 -28.46 36.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.538 176.569 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -153.31 102.85 2.64 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.959 -176.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 73.9 m . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.608 -0.71 . . . . 0.0 109.912 176.129 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 . . . . . 0 N--CA 1.48 1.049 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.4 p-10 -90.87 140.14 30.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.911 0.386 . . . . 0.0 110.839 -178.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 35.2 t -77.63 79.45 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 177.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.1 p -104.89 106.48 16.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.922 -177.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -132.97 133.33 43.02 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.921 177.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.6 tp60 -69.91 145.94 51.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.126 0.489 . . . . 0.0 110.94 -178.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 28.8 p-10 -117.87 155.64 29.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.305 0.574 . . . . 0.0 110.482 177.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 17.4 t -90.8 109.69 36.44 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.225 176.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.51 ' HG2' ' HG ' ' A' ' 57' ' ' LEU . 20.6 Cg_exo -64.75 -25.72 60.83 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.387 2.058 . . . . 0.0 111.775 179.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.551 HD11 HD11 ' A' ' 57' ' ' LEU . 10.3 mm -62.81 -28.03 44.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 115.179 -0.919 . . . . 0.0 111.591 -173.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.1 p -155.59 12.1 0.33 Allowed 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 111.588 0.218 . . . . 0.0 111.588 -178.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 76.1 mt 52.37 79.56 0.11 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 122.838 0.455 . . . . 0.0 111.65 -177.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -144.32 167.6 22.06 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.227 -177.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -73.95 132.07 42.07 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.783 -177.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.9 mt -137.64 126.18 33.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 C-N-CA 122.927 0.491 . . . . 0.0 109.774 174.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 66.2 m170 -116.29 -172.46 2.18 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.941 0.401 . . . . 0.0 111.231 -178.188 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.9 t -61.24 -17.66 54.44 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.676 -176.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.3 t -59.8 99.51 0.07 Allowed 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.994 0.426 . . . . 0.0 111.101 -177.316 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.41 ' HD2' ' C ' ' A' ' 28' ' ' ARG . 0.7 OUTLIER -88.81 -1.92 58.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.435 178.2 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.3 p -89.95 -38.44 11.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.391 179.141 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 93.8 t -75.28 -54.94 12.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 175.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -86.85 137.37 32.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.161 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.9 t60 -73.96 134.1 43.09 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -179.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 9.0 p -96.14 121.89 47.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-O 121.267 0.556 . . . . 0.0 111.113 -178.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.602 HD12 ' HB2' ' A' ' 38' ' ' HIS . 86.1 mt -70.58 155.87 92.76 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.445 175.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -65.3 -15.73 51.32 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 122.341 2.027 . . . . 0.0 111.813 178.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 46.5 t -93.63 8.42 40.92 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.334 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 83.32 23.66 53.72 Favored Glycine 0 C--N 1.336 0.548 0 CA-C-N 116.006 -0.543 . . . . 0.0 114.056 172.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.677 ' HB3' HD22 ' A' ' 57' ' ' LEU . 44.9 m-70 -103.81 155.57 18.5 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 117.303 0.551 . . . . 0.0 110.271 175.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 61.3 mt -113.49 138.22 50.43 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.443 176.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.527 HD13 ' HB2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -156.75 149.29 23.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.82 175.648 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.425 ' CD2' ' HB2' ' A' ' 44' ' ' CYS . 0.0 OUTLIER -68.58 168.92 12.0 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.06 179.73 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.474 ' O ' ' HB3' ' A' ' 45' ' ' TYR . 8.3 mmt180 -53.05 -60.73 2.92 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.651 -168.564 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 28.8 m -61.73 -43.8 98.16 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.992 0.425 . . . . 0.0 110.856 -178.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.425 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . 0.5 OUTLIER -61.84 -26.47 68.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.2 -178.374 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.527 ' HB2' HD13 ' A' ' 40' ' ' LEU . 48.3 t80 -62.17 -49.51 75.55 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.214 0.53 . . . . 0.0 109.578 173.34 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -59.64 -46.56 88.62 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.188 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -56.63 -56.16 24.86 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.882 -175.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 15.4 ttp -64.96 -47.03 79.08 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.256 0.55 . . . . 0.0 110.47 -175.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 61.6 tp -66.42 -28.84 68.93 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.834 -177.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -65.21 -46.41 80.81 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.961 0.41 . . . . 0.0 110.586 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.474 ' HB2' ' CD1' ' A' ' 53' ' ' TYR . 14.1 mm-40 -65.52 -23.81 66.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.802 -177.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 63.18 43.13 99.07 Favored Glycine 0 C--N 1.331 0.27 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.832 176.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.474 ' CD1' ' HB2' ' A' ' 51' ' ' GLU . 3.3 p90 -118.16 161.34 20.02 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.505 ' CD ' ' H ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -55.75 137.48 49.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.269 0.557 . . . . 0.0 111.107 179.803 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -63.39 115.67 19.85 Favored Pre-proline 0 CA--C 1.535 0.387 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.671 -171.495 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.765 ' HA ' ' SD ' ' A' ' 59' ' ' MET . 41.2 Cg_endo -66.46 -12.4 35.57 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 122.895 2.397 . . . . 0.0 112.356 -179.431 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.677 HD22 ' HB3' ' A' ' 38' ' ' HIS . 4.4 mp -79.28 -8.23 58.9 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 110.295 -0.261 . . . . 0.0 110.295 178.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -73.79 -48.54 30.81 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.894 0.378 . . . . 0.0 110.247 176.492 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.765 ' SD ' ' HA ' ' A' ' 56' ' ' PRO . 1.4 pmm? -90.83 -17.43 26.59 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.374 177.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 19.1 t-80 64.49 121.11 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.969 176.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 68.3 m . . . . . 0 C--O 1.25 1.085 0 CA-C-O 119.004 -0.522 . . . . 0.0 109.807 174.815 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_