data_2me7_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 2me7 _Structure_validation_residue.Date_analyzed 2016-10-08 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 ' 6' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 . . . . . 0 CA--C 1.536 0.429 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 53.9 tp -58.26 -45.25 88.16 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-O 117.909 -1.043 . . . . 0.0 112.316 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.2 -39.81 79.92 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 120.208 1.367 . . . . 0.0 112.957 175.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 32.5 ttp180 -78.16 -33.94 49.97 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.291 1.437 . . . . 0.0 113.379 -179.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 35.6 t -69.19 -40.82 77.82 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 126.062 1.745 . . . . 0.0 109.933 171.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -61.64 -44.72 96.45 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.291 1.037 . . . . 0.0 111.639 175.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 26.8 mt -66.77 -28.72 68.62 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.177 1.391 . . . . 0.0 113.62 173.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 63.1 m -77.93 -47.78 17.83 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.729 1.212 . . . . 0.0 112.085 175.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 68.4 m -67.49 -31.6 71.85 Favored 'General case' 0 CA--C 1.549 0.91 0 O-C-N 121.248 -0.908 . . . . 0.0 111.774 178.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 42.4 ttm-85 -53.64 -32.95 53.5 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.529 1.532 . . . . 0.0 112.964 166.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.0 m -71.46 -16.74 62.38 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 114.301 1.222 . . . . 0.0 114.301 177.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.1 mt -108.27 -11.06 15.28 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.401 1.08 . . . . 0.0 112.459 175.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 98.42 27.19 8.77 Favored Glycine 0 CA--C 1.537 1.407 0 C-N-CA 125.621 1.581 . . . . 0.0 115.635 174.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -145.28 178.64 7.94 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 119.232 1.516 . . . . 0.0 112.725 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.3 tp -86.78 148.57 25.35 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.913 1.285 . . . . 0.0 111.639 -170.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -100.09 143.24 16.28 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 123.915 0.769 . . . . 0.0 114.099 173.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.13 157.4 44.93 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 127.344 2.258 . . . . 0.0 110.474 169.281 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 85.7 m -100.19 133.71 44.18 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.417 -0.802 . . . . 0.0 110.533 171.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 71.6 mt -138.5 125.14 25.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.181 1.393 . . . . 0.0 108.617 177.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.63 33.2 76.21 Favored Glycine 0 CA--C 1.539 1.552 0 O-C-N 121.487 -0.758 . . . . 0.0 114.265 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 60.72 21.11 11.13 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 127.043 2.137 . . . . 0.0 114.907 -172.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -120.72 152.5 38.19 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.156 1.783 . . . . 0.0 110.953 173.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 33.2 t -76.75 131.02 38.5 Favored 'General case' 0 C--O 1.241 0.657 0 O-C-N 121.593 -0.692 . . . . 0.0 110.525 176.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 42.9 tttt -139.35 127.61 22.67 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.729 1.212 . . . . 0.0 109.974 175.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 12.5 m -89.79 151.79 21.62 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.606 -177.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.4 m -141.05 150.55 59.47 Favored Pre-proline 0 N--CA 1.474 0.737 0 C-N-CA 124.883 1.273 . . . . 0.0 113.112 -175.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -79.19 65.89 8.82 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 124.66 3.574 . . . . 0.0 112.845 -175.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 . . . . . 0 C--O 1.253 1.261 0 C-N-CA 128.404 2.682 . . . . 0.0 114.159 -179.932 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 . . . . . 0 CA--C 1.532 0.253 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 44.4 tp -53.91 -40.53 66.76 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 119.275 0.943 . . . . 0.0 112.001 167.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.29 -42.07 84.35 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.703 1.138 . . . . 0.0 112.981 177.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 31.8 mtp180 -69.13 -36.25 77.27 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.658 1.183 . . . . 0.0 112.386 177.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 16.0 t -78.0 -36.38 48.87 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 125.694 1.598 . . . . 0.0 110.854 178.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -55.09 -47.61 74.7 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.58 0.752 . . . . 0.0 111.258 167.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 53.5 mt -63.14 -50.73 69.27 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.222 0.609 . . . . 0.0 111.884 174.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 44.4 m -64.02 -43.51 95.37 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -176.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 78.6 m -65.44 -35.17 80.12 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.189 0.904 . . . . 0.0 112.631 173.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 26.4 ttm105 -69.77 -19.59 63.51 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 120.994 -1.066 . . . . 0.0 113.046 178.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.2 p -62.92 -31.1 72.1 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 118.569 0.622 . . . . 0.0 112.511 166.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 mt -91.31 -6.04 53.73 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.531 1.132 . . . . 0.0 112.555 173.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.24 12.46 39.07 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 126.623 2.059 . . . . 0.0 115.916 174.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -134.79 -177.71 4.75 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 120.08 1.94 . . . . 0.0 113.473 -175.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 80.6 mt -94.14 164.03 13.22 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.6 1.16 . . . . 0.0 111.894 -169.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -117.3 146.54 18.78 Favored Glycine 0 N--CA 1.474 1.225 0 N-CA-C 116.119 1.208 . . . . 0.0 116.119 -171.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 57.4 mmtt -133.9 134.38 42.6 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 127.348 2.259 . . . . 0.0 111.664 165.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 53.6 t -114.0 109.53 18.61 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.916 1.286 . . . . 0.0 109.925 -177.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 36.9 mm -140.14 127.06 23.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 124.475 1.11 . . . . 0.0 109.723 -167.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.29 29.72 75.8 Favored Glycine 0 CA--C 1.536 1.371 0 CA-C-O 119.379 -0.678 . . . . 0.0 114.609 177.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 62.46 29.32 17.11 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.933 1.693 . . . . 0.0 114.484 -175.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -135.41 155.03 51.22 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.569 1.948 . . . . 0.0 109.917 168.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 10.0 t -107.77 135.38 49.29 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.32 1.048 . . . . 0.0 112.321 -175.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 66.1 mmtt -136.83 153.62 50.74 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 127.156 2.182 . . . . 0.0 111.307 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 12.3 m -115.95 149.35 38.89 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 -174.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.3 m -138.6 156.97 72.9 Favored Pre-proline 0 N--CA 1.481 1.087 0 C-N-CA 127.051 2.14 . . . . 0.0 113.07 -170.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -83.44 165.37 14.34 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 124.069 3.179 . . . . 0.0 114.684 -173.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 . . . . . 0 C--O 1.256 1.402 0 C-N-CA 125.53 1.532 . . . . 0.0 112.012 167.595 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 45.3 t30 . . . . . 0 CA--C 1.534 0.348 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 46.7 tp -57.67 -34.44 69.39 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 118.719 -0.658 . . . . 0.0 112.137 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.23 -46.63 87.96 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 118.975 0.807 . . . . 0.0 112.686 176.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 18.7 ttt180 -66.12 -45.02 82.59 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 126.038 1.735 . . . . 0.0 111.994 175.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 49.7 t -65.55 -44.66 86.15 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 125.402 1.481 . . . . 0.0 111.222 -176.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -54.64 -52.02 63.6 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.562 0.745 . . . . 0.0 111.16 176.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 16.6 tp -73.76 -28.25 61.58 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.662 1.185 . . . . 0.0 113.299 -176.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.4 m -73.4 -47.53 41.19 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.678 0.791 . . . . 0.0 110.867 173.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 95.7 m -60.89 -31.55 71.04 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 171.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -52.82 -32.2 42.96 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.355 1.062 . . . . 0.0 113.649 173.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 54.6 p -63.58 -24.27 67.73 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.3 mt -97.71 -8.75 27.99 Favored 'General case' 0 N--CA 1.477 0.903 0 O-C-N 121.047 -1.033 . . . . 0.0 112.22 174.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 111.47 6.6 25.2 Favored Glycine 0 CA--C 1.532 1.156 0 C-N-CA 126.716 2.103 . . . . 0.0 115.586 172.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -130.01 -172.04 2.68 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 119.972 1.886 . . . . 0.0 114.953 -167.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.2 mt -92.9 157.69 16.23 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.306 1.442 . . . . 0.0 111.203 -176.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -110.39 147.96 17.49 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 124.911 1.243 . . . . 0.0 113.941 174.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -134.23 148.68 50.89 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 126.948 2.099 . . . . 0.0 111.184 167.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.6 m -108.93 125.33 51.91 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.019 1.328 . . . . 0.0 111.1 175.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 mp -131.42 113.35 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 124.898 1.279 . . . . 0.0 110.145 177.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.68 -94.35 0.16 Allowed Glycine 0 CA--C 1.529 0.955 0 C-N-CA 124.139 0.876 . . . . 0.0 111.888 -177.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -114.74 -11.04 12.35 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.809 2.043 . . . . 0.0 113.657 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -112.82 139.88 48.08 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.298 1.039 . . . . 0.0 113.138 -164.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 16.8 t -85.75 122.41 29.8 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 125.168 1.387 . . . . 0.0 109.404 164.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -121.5 143.58 49.19 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.524 1.53 . . . . 0.0 109.117 172.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 10.7 m -99.2 149.35 23.17 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -178.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.9 m -140.92 152.26 64.87 Favored Pre-proline 0 N--CA 1.477 0.893 0 C-N-CA 125.032 1.333 . . . . 0.0 113.772 -174.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -70.58 170.28 17.94 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 124.221 3.281 . . . . 0.0 112.978 176.217 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 . . . . . 0 C--O 1.251 1.166 0 C-N-CA 125.015 1.326 . . . . 0.0 112.349 176.115 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 . . . . . 0 N--CA 1.465 0.324 0 CA-C-O 120.682 0.277 . . . . 0.0 110.6 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 36.4 tp -58.17 -35.68 71.93 Favored 'General case' 0 C--O 1.223 -0.326 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 -177.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.43 -45.12 63.49 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 120.327 1.421 . . . . 0.0 111.704 176.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 21.1 ttm180 -63.05 -36.08 82.39 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.364 1.465 . . . . 0.0 112.926 177.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 28.1 t -77.75 -41.27 38.19 Favored 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 126.854 2.062 . . . . 0.0 111.03 176.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -58.77 -48.77 80.07 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.165 0.893 . . . . 0.0 111.023 171.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 75.3 mt -63.36 -37.32 86.82 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.704 0.802 . . . . 0.0 112.467 177.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 62.9 m -65.75 -51.11 61.89 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.329 0.651 . . . . 0.0 111.821 174.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.2 m -69.83 -35.44 74.77 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -179.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 36.1 ttm105 -65.85 -25.02 67.01 Favored 'General case' 0 N--CA 1.481 1.106 0 O-C-N 120.846 -1.159 . . . . 0.0 113.078 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.6 p -67.63 -15.65 63.76 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 169.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -104.95 -4.78 21.69 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 125.649 1.579 . . . . 0.0 112.306 175.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 97.44 17.31 31.73 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 126.511 2.005 . . . . 0.0 116.348 176.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -143.13 177.16 8.57 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 119.439 1.619 . . . . 0.0 113.365 -178.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.8 tp -91.23 145.78 24.38 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.196 0.998 . . . . 0.0 111.602 -169.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -99.77 141.68 15.59 Favored Glycine 0 N--CA 1.473 1.103 0 O-C-N 121.644 -0.66 . . . . 0.0 113.573 178.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -148.2 126.94 12.57 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 126.409 1.884 . . . . 0.0 109.01 -176.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 56.7 m -82.27 133.69 35.25 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.147 -0.971 . . . . 0.0 110.819 -177.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 50.5 mt -125.22 118.57 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 123.815 0.846 . . . . 0.0 109.096 175.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 68.67 -83.39 0.21 Allowed Glycine 0 CA--C 1.524 0.643 0 C-N-CA 125.709 1.623 . . . . 0.0 111.742 -176.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -143.1 3.1 1.35 Allowed 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.075 1.75 . . . . 0.0 112.831 -176.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -133.88 158.38 43.58 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.556 1.542 . . . . 0.0 112.751 -172.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 41.4 t -87.51 130.28 34.77 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.737 1.215 . . . . 0.0 112.479 -175.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -127.66 159.8 33.58 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 127.14 2.176 . . . . 0.0 109.744 172.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 8.3 m -122.59 141.53 51.6 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -176.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.5 m -133.52 157.89 76.92 Favored Pre-proline 0 N--CA 1.475 0.78 0 C-N-CA 126.702 2.001 . . . . 0.0 112.694 -167.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.5 154.73 68.38 Favored 'Trans proline' 0 C--O 1.241 0.643 0 C-N-CA 123.367 2.711 . . . . 0.0 112.454 171.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 . . . . . 0 C--O 1.252 1.225 0 C-N-CA 126.292 1.837 . . . . 0.0 112.528 175.209 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 . . . . . 0 CA--C 1.537 0.473 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.5 tp -62.8 -35.7 80.74 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-O 117.973 -1.013 . . . . 0.0 112.555 -175.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.74 -45.57 82.12 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 120.117 1.326 . . . . 0.0 111.998 173.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -60.41 -44.71 95.45 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 123.926 0.89 . . . . 0.0 111.465 176.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 33.9 t -68.66 -43.69 75.66 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 124.916 1.286 . . . . 0.0 110.946 178.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -53.84 -52.52 60.12 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 124.015 0.926 . . . . 0.0 110.545 176.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 75.7 mt -75.07 -37.64 61.55 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.435 1.094 . . . . 0.0 113.439 -176.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.9 m -60.17 -41.17 92.29 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.0 0.818 . . . . 0.0 111.182 170.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 73.8 m -71.66 -33.11 68.6 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 171.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.55 -35.7 76.67 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 120.74 -1.225 . . . . 0.0 112.382 178.277 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.6 m -62.48 -6.82 3.69 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 174.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -115.3 -3.57 12.47 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 125.476 1.511 . . . . 0.0 113.391 174.199 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.26 29.7 8.75 Favored Glycine 0 CA--C 1.541 1.675 0 C-N-CA 125.028 1.299 . . . . 0.0 116.17 175.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -150.89 -173.02 4.36 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.413 1.485 . . . . 0.0 112.026 178.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 11.1 mp -105.05 156.67 17.84 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.599 1.159 . . . . 0.0 111.726 -175.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -112.02 139.98 15.92 Favored Glycine 0 CA--C 1.525 0.675 0 C-N-CA 124.99 1.281 . . . . 0.0 113.155 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -131.12 149.78 52.44 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 126.593 1.957 . . . . 0.0 110.564 177.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 27.4 m -101.28 129.38 47.24 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 124.101 0.96 . . . . 0.0 111.98 -174.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 25.2 mt -128.35 90.74 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 124.908 1.283 . . . . 0.0 109.152 -174.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.76 -73.77 0.25 Allowed Glycine 0 CA--C 1.534 1.272 0 C-N-CA 125.964 1.745 . . . . 0.0 114.452 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -135.18 -2.75 2.5 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.684 1.994 . . . . 0.0 112.752 176.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -108.14 153.94 22.43 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 127.437 2.295 . . . . 0.0 111.32 -173.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 11.7 t -106.05 130.42 53.97 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.469 1.508 . . . . 0.0 110.064 171.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.4 mptt -126.99 148.36 50.1 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.201 1.801 . . . . 0.0 110.418 175.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 10.3 m -110.0 124.95 52.35 Favored 'General case' 0 C--O 1.238 0.48 0 C-N-CA 123.818 0.847 . . . . 0.0 111.742 -178.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.0 m -99.21 144.91 29.11 Favored Pre-proline 0 N--CA 1.471 0.607 0 C-N-CA 126.008 1.723 . . . . 0.0 113.493 -167.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -74.99 117.87 5.07 Favored 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 123.091 2.527 . . . . 0.0 115.048 -153.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 . . . . . 0 C--O 1.256 1.43 0 C-N-CA 126.856 2.062 . . . . 0.0 112.554 170.059 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 . . . . . 0 CA--C 1.533 0.311 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.1 tp -67.69 -32.52 73.24 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-O 118.552 -0.737 . . . . 0.0 111.884 -174.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.36 -43.53 98.6 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 119.37 0.986 . . . . 0.0 111.895 174.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 32.7 ttp85 -70.98 -36.1 72.38 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 125.38 1.472 . . . . 0.0 112.803 177.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 37.7 t -73.33 -39.69 65.05 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 126.003 1.721 . . . . 0.0 111.119 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -57.98 -52.1 66.92 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 123.43 0.692 . . . . 0.0 109.867 171.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 76.4 mt -59.31 -41.21 88.51 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 119.275 0.943 . . . . 0.0 112.639 174.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.2 m -64.03 -47.37 80.51 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.861 0.865 . . . . 0.0 112.369 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 93.7 m -73.01 -37.23 67.03 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 177.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 40.8 ttm-85 -70.3 -23.47 62.86 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.696 1.198 . . . . 0.0 112.239 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.6 m -63.3 -17.35 62.44 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.26 1.024 . . . . 0.0 113.672 166.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.07 -0.19 25.02 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 126.195 1.798 . . . . 0.0 112.547 173.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.86 26.86 30.63 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 125.266 1.412 . . . . 0.0 116.169 175.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -144.63 -179.69 6.73 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.651 1.581 . . . . 0.0 113.092 176.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 21.6 tp -88.19 141.49 28.52 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.581 1.552 . . . . 0.0 111.745 -167.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -93.56 141.88 15.74 Favored Glycine 0 CA--C 1.532 1.135 0 O-C-N 121.931 -0.481 . . . . 0.0 113.82 174.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -138.72 151.56 47.25 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.819 2.048 . . . . 0.0 111.758 172.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 33.6 m -103.18 114.26 28.41 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.75 1.22 . . . . 0.0 110.094 174.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 51.5 mt -141.24 107.8 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 124.92 1.288 . . . . 0.0 110.699 -173.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.7 51.28 5.23 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 124.9 1.238 . . . . 0.0 113.282 177.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 79.3 mt-10 57.7 10.43 1.05 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 126.252 1.821 . . . . 0.0 114.655 -171.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -133.7 154.73 50.72 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.859 1.663 . . . . 0.0 112.755 -168.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 40.0 t -83.07 135.86 34.68 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.39 1.076 . . . . 0.0 111.611 175.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 30.7 tptt -142.51 146.88 35.16 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.968 1.707 . . . . 0.0 110.746 176.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.0 m -105.56 144.13 32.75 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.8 m -135.35 156.02 78.23 Favored Pre-proline 0 N--CA 1.474 0.77 0 C-N-CA 126.285 1.834 . . . . 0.0 110.916 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -63.13 155.03 63.72 Favored 'Trans proline' 0 CA--C 1.536 0.58 0 C-N-CA 122.568 2.178 . . . . 0.0 112.245 173.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 . . . . . 0 C--O 1.251 1.149 0 C-N-CA 124.194 0.998 . . . . 0.0 111.561 171.507 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 . . . . . 0 CA--C 1.537 0.473 0 N-CA-C 108.623 -0.881 . . . . 0.0 108.623 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 42.8 tp -61.76 -38.16 86.96 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 117.924 -1.036 . . . . 0.0 113.0 -175.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -69.35 -38.11 77.98 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 120.569 1.532 . . . . 0.0 112.448 176.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.5 tmm_? -61.96 -38.89 90.24 Favored 'General case' 0 C--N 1.344 0.369 0 C-N-CA 124.633 1.173 . . . . 0.0 112.999 172.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 34.4 t -77.76 -38.73 46.24 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 125.313 1.445 . . . . 0.0 111.404 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -62.31 -45.49 93.03 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.518 0.599 . . . . 0.0 110.294 177.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 39.0 tp -62.16 -44.36 96.78 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.722 1.209 . . . . 0.0 112.506 172.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.8 m -60.64 -50.3 74.08 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 122.791 0.437 . . . . 0.0 110.934 178.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 80.5 m -66.25 -34.97 79.22 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 177.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 55.3 ttm-85 -58.06 -38.01 75.5 Favored 'General case' 0 N--CA 1.479 0.984 0 O-C-N 120.877 -1.14 . . . . 0.0 111.985 173.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 21.2 p -63.01 -17.51 62.28 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 176.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 mt -102.39 -10.68 19.24 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.773 1.229 . . . . 0.0 112.603 176.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 106.32 20.0 9.5 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 125.755 1.645 . . . . 0.0 116.399 176.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -149.49 -173.19 4.33 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 119.465 1.633 . . . . 0.0 113.169 -177.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 26.2 tp -98.25 157.93 15.87 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.256 1.422 . . . . 0.0 111.732 -174.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -116.93 147.98 18.88 Favored Glycine 0 N--CA 1.471 1.032 0 N-CA-C 115.251 0.861 . . . . 0.0 115.251 -178.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -136.43 153.3 51.11 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 128.168 2.587 . . . . 0.0 110.854 171.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 50.5 m -98.67 115.14 28.03 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.638 1.175 . . . . 0.0 109.566 171.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.6 mm -127.77 119.87 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 125.725 1.61 . . . . 0.0 108.965 -176.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.22 40.88 92.42 Favored Glycine 0 CA--C 1.533 1.194 0 C-N-CA 123.631 0.634 . . . . 0.0 113.113 -173.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 49.32 30.87 3.42 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 127.41 2.284 . . . . 0.0 115.52 -170.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -128.09 151.78 48.78 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.796 1.638 . . . . 0.0 110.144 171.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 53.4 t -75.52 137.49 40.91 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.468 -0.77 . . . . 0.0 111.136 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -147.92 130.44 15.83 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 127.291 2.237 . . . . 0.0 109.057 -173.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 13.2 m -107.48 146.58 31.59 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 122.581 1.182 . . . . 0.0 113.755 -171.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.7 m -138.5 156.94 73.07 Favored Pre-proline 0 N--CA 1.476 0.862 0 C-N-CA 126.703 2.001 . . . . 0.0 111.733 -172.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -64.91 144.49 83.08 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.677 2.251 . . . . 0.0 111.008 169.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 52.3 m-85 . . . . . 0 C--O 1.256 1.434 0 C-N-CA 125.288 1.435 . . . . 0.0 113.177 -178.649 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 62.8 t-20 . . . . . 0 C--O 1.237 0.413 0 N-CA-C 109.997 -0.371 . . . . 0.0 109.997 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.8 tp -57.89 -34.96 70.37 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-O 117.763 -1.113 . . . . 0.0 112.74 176.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.88 -38.12 89.92 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 120.439 1.472 . . . . 0.0 112.675 177.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.9 ttm105 -78.84 -28.64 44.34 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 120.88 -1.138 . . . . 0.0 113.058 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 32.5 t -73.11 -41.62 63.83 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 125.372 1.469 . . . . 0.0 109.995 172.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -57.87 -46.2 85.21 Favored 'General case' 0 C--O 1.221 -0.409 0 C-N-CA 124.922 1.289 . . . . 0.0 110.0 174.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 39.0 tp -62.51 -50.72 70.26 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.232 1.013 . . . . 0.0 112.041 173.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 72.8 m -56.82 -37.87 71.81 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.378 1.071 . . . . 0.0 112.359 -179.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 68.8 m -85.12 -37.42 20.26 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 112.994 0.738 . . . . 0.0 112.994 178.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 28.9 ttm105 -64.55 -28.82 69.9 Favored 'General case' 0 N--CA 1.479 1.022 0 O-C-N 120.978 -1.076 . . . . 0.0 112.543 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.3 m -62.08 -24.62 67.22 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 170.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mt -96.31 -9.66 29.65 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.373 0.988 . . . . 0.0 112.299 176.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 101.19 20.42 13.85 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 125.391 1.472 . . . . 0.0 115.77 176.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -138.16 -173.25 3.47 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.816 1.646 . . . . 0.0 111.679 176.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 79.2 mt -103.93 161.77 13.69 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.334 1.053 . . . . 0.0 112.801 -170.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -96.2 151.97 20.09 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 124.348 0.975 . . . . 0.0 114.037 179.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.1 tptt -143.1 124.0 14.31 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 126.99 2.116 . . . . 0.0 110.371 173.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.6 m -100.02 122.03 42.28 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 123.555 0.742 . . . . 0.0 110.003 176.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.4 mp -115.58 99.66 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 176.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.48 -94.61 0.03 OUTLIER Glycine 0 CA--C 1.531 1.078 0 C-N-CA 125.84 1.686 . . . . 0.0 113.624 -176.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -104.16 -3.87 23.86 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.11 1.364 . . . . 0.0 114.475 -173.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -139.6 152.34 46.74 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 120.459 1.481 . . . . 0.0 113.602 -175.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 14.5 t -92.66 135.85 33.74 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.989 2.115 . . . . 0.0 112.703 -179.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -122.33 156.83 33.08 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 128.835 2.854 . . . . 0.0 109.23 171.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 28.8 m -112.14 141.37 45.91 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 118.895 0.771 . . . . 0.0 112.644 173.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.2 m -129.82 151.12 77.62 Favored Pre-proline 0 N--CA 1.471 0.622 0 C-N-CA 126.603 1.961 . . . . 0.0 112.245 -171.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -72.87 158.76 49.55 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.756 2.971 . . . . 0.0 113.696 -178.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 . . . . . 0 C--O 1.253 1.276 0 C-N-CA 125.787 1.635 . . . . 0.0 112.464 171.013 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 . . . . . 0 CA--C 1.543 0.697 0 CA-C-O 120.768 0.318 . . . . 0.0 111.111 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 60.8 tp -60.09 -38.32 82.57 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 117.75 -1.119 . . . . 0.0 112.94 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.34 -34.66 78.49 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 120.761 1.619 . . . . 0.0 113.319 179.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 48.2 ttp180 -69.15 -39.35 78.85 Favored 'General case' 0 C--N 1.343 0.293 0 C-N-CA 125.564 1.545 . . . . 0.0 111.593 171.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 24.5 t -70.9 -41.59 71.07 Favored 'General case' 0 C--O 1.22 -0.456 0 C-N-CA 125.21 1.404 . . . . 0.0 110.767 178.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -60.0 -50.65 72.92 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.787 1.235 . . . . 0.0 109.658 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 37.0 tp -62.52 -40.9 98.24 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.064 1.346 . . . . 0.0 112.696 176.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 71.0 m -62.29 -47.09 85.83 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.915 0.886 . . . . 0.0 111.127 174.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.0 m -72.46 -28.26 62.82 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 178.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.65 -37.23 78.15 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.636 -1.29 . . . . 0.0 113.474 177.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 95.1 p -77.03 -2.75 35.6 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.32 1.23 . . . . 0.0 114.32 -178.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -110.25 -1.52 17.26 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.47 1.508 . . . . 0.0 112.32 167.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.48 31.92 12.64 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 125.501 1.525 . . . . 0.0 115.706 175.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -147.25 -169.97 3.44 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-N 119.796 1.798 . . . . 0.0 114.529 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.0 tp -100.09 148.84 24.12 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.465 1.906 . . . . 0.0 111.538 -168.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -93.58 142.91 16.22 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 124.2 0.905 . . . . 0.0 113.784 176.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.0 tptt -132.96 143.35 49.4 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 127.735 2.414 . . . . 0.0 111.442 172.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 26.4 t -105.38 113.48 27.09 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 125.472 1.509 . . . . 0.0 109.795 172.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 60.8 mt -135.83 121.7 30.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 124.472 1.109 . . . . 0.0 108.326 -174.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.58 35.47 62.11 Favored Glycine 0 CA--C 1.535 1.31 0 O-C-N 122.104 -0.372 . . . . 0.0 113.508 -177.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.257 42.9 mt-10 58.45 20.83 7.82 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 126.499 1.92 . . . . 0.0 115.691 -177.515 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -117.41 155.02 30.35 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.899 1.279 . . . . 0.0 111.732 162.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 36.6 t -77.57 135.3 38.16 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.087 0.955 . . . . 0.0 111.357 175.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.9 tptp -140.61 128.81 22.29 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 126.029 1.731 . . . . 0.0 108.802 175.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 16.5 m -86.45 146.4 26.44 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.843 0.83 . . . . 0.0 112.245 179.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.9 m -140.83 161.46 53.98 Favored Pre-proline 0 N--CA 1.473 0.677 0 C-N-CA 127.064 2.145 . . . . 0.0 110.92 -170.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.31 153.85 76.32 Favored 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 122.522 2.148 . . . . 0.0 113.866 174.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 . . . . . 0 C--O 1.258 1.504 0 C-N-CA 125.746 1.618 . . . . 0.0 111.951 162.43 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 . . . . . 0 CA--C 1.546 0.789 0 CA-C-O 121.046 0.451 . . . . 0.0 111.897 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 55.8 tp -65.02 -39.76 93.87 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 117.736 -1.126 . . . . 0.0 112.948 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.64 -41.06 96.4 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 120.598 1.544 . . . . 0.0 112.28 179.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 25.7 ttm180 -67.01 -36.45 82.18 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 126.206 1.803 . . . . 0.0 112.341 175.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 19.8 t -76.15 -38.97 56.06 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 124.776 1.23 . . . . 0.0 111.084 177.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -60.39 -45.17 94.53 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.847 0.859 . . . . 0.0 109.921 173.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -60.49 -47.4 86.29 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.253 1.421 . . . . 0.0 111.433 173.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.5 m -63.42 -36.87 85.18 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.221 1.008 . . . . 0.0 112.787 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 84.1 m -85.41 -35.51 21.26 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 28.2 ttm105 -69.93 -24.26 63.34 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 120.561 -1.337 . . . . 0.0 112.014 175.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 65.6 m -62.44 -15.8 51.49 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 164.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 12.0 mt -101.85 -32.81 10.06 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.903 1.228 . . . . 0.0 111.546 173.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.6 -4.28 4.0 Favored Glycine 0 CA--C 1.536 1.362 0 C-N-CA 125.19 1.376 . . . . 0.0 115.389 174.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -119.49 -163.16 0.96 Allowed 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.144 2.178 . . . . 0.0 112.036 -173.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.4 mp -108.81 163.36 13.34 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.633 1.573 . . . . 0.0 111.499 -175.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -113.35 152.04 18.12 Favored Glycine 0 CA--C 1.536 1.38 0 C-N-CA 125.304 1.43 . . . . 0.0 114.97 -178.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 49.8 mmtt -142.22 152.78 43.43 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 128.752 2.821 . . . . 0.0 111.927 173.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 31.8 m -97.13 108.06 20.71 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.181 1.393 . . . . 0.0 110.421 170.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 49.4 mt -131.76 126.07 56.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 125.986 1.714 . . . . 0.0 109.272 -173.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 63.25 25.35 68.24 Favored Glycine 0 CA--C 1.54 1.626 0 C-N-CA 123.831 0.729 . . . . 0.0 114.288 -174.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 61.55 16.46 7.66 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 127.308 2.243 . . . . 0.0 115.098 -167.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -112.7 160.02 18.34 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.273 1.429 . . . . 0.0 111.753 169.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 40.8 t -72.22 136.57 46.42 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.405 -0.809 . . . . 0.0 111.38 167.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.2 tttt -141.68 141.34 33.34 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 126.666 1.986 . . . . 0.0 110.017 173.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.7 m -100.02 149.95 22.94 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.852 -0.53 . . . . 0.0 112.408 -177.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.4 m -138.29 147.07 54.16 Favored Pre-proline 0 N--CA 1.476 0.851 0 C-N-CA 125.29 1.436 . . . . 0.0 113.272 -179.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -76.1 161.01 36.04 Favored 'Trans proline' 0 CA--C 1.538 0.689 0 C-N-CA 124.632 3.554 . . . . 0.0 112.917 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 18.2 p90 . . . . . 0 C--O 1.25 1.128 0 C-N-CA 125.683 1.593 . . . . 0.0 113.628 179.947 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 53.6 t-20 . . . . . 0 CA--C 1.534 0.357 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 33.3 tp -61.18 -30.72 70.58 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 117.92 -1.038 . . . . 0.0 112.624 -177.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.87 -51.59 68.65 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 120.127 1.33 . . . . 0.0 112.053 170.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -58.92 -41.64 87.77 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 125.915 1.686 . . . . 0.0 111.909 178.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.2 t -70.8 -48.3 54.93 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.033 1.733 . . . . 0.0 111.701 178.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.65 -44.44 85.67 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.402 1.081 . . . . 0.0 111.79 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -78.81 -29.43 44.81 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.211 1.404 . . . . 0.0 113.26 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.9 m -74.86 -40.02 61.22 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 118.769 0.713 . . . . 0.0 112.228 173.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 84.1 m -66.96 -32.72 74.15 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 118.032 0.378 . . . . 0.0 111.397 169.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -54.0 -38.77 65.45 Favored 'General case' 0 N--CA 1.48 1.026 0 O-C-N 121.016 -1.053 . . . . 0.0 112.897 172.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 73.1 m -72.76 -14.02 61.45 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 115.192 1.553 . . . . 0.0 115.192 -178.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.1 mt -95.75 -13.97 23.73 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.462 0.705 . . . . 0.0 111.441 167.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.97 30.67 5.96 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 126.486 1.993 . . . . 0.0 115.065 177.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -142.73 -163.47 1.63 Allowed 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 119.808 1.804 . . . . 0.0 113.025 176.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.2 mp -108.36 164.64 12.15 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.544 1.938 . . . . 0.0 111.58 -177.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -119.8 154.95 16.28 Favored Glycine 0 CA--C 1.538 1.478 0 C-N-CA 124.835 1.207 . . . . 0.0 115.126 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -135.78 152.82 51.5 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 128.257 2.623 . . . . 0.0 111.249 168.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.7 m -114.89 106.71 14.49 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.156 1.382 . . . . 0.0 112.223 176.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.432 ' CG2' ' H ' ' A' ' 25' ' ' GLY . 28.0 mm -87.61 -168.5 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 127.179 2.192 . . . . 0.0 108.486 174.051 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.432 ' H ' ' CG2' ' A' ' 24' ' ' ILE . . . -57.12 95.68 0.05 OUTLIER Glycine 0 CA--C 1.53 0.972 0 C-N-CA 125.11 1.338 . . . . 0.0 112.768 179.135 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 46.07 30.91 1.02 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 127.6 2.36 . . . . 0.0 114.986 -171.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -140.32 133.8 30.04 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.682 1.193 . . . . 0.0 113.934 -178.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 9.6 t -87.62 124.54 33.64 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 125.814 1.646 . . . . 0.0 110.902 175.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -119.26 147.97 43.67 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.204 1.802 . . . . 0.0 109.281 174.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 19.4 m -106.03 146.48 30.06 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 118.773 0.715 . . . . 0.0 111.533 174.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.6 m -133.51 153.11 80.19 Favored Pre-proline 0 N--CA 1.477 0.914 0 C-N-CA 125.786 1.634 . . . . 0.0 113.916 -169.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -66.87 146.0 76.51 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 124.122 3.214 . . . . 0.0 112.537 173.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 20.2 p90 . . . . . 0 C--O 1.255 1.372 0 C-N-CA 126.622 1.969 . . . . 0.0 112.707 -169.918 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 . . . . . 0 N--CA 1.469 0.486 0 N-CA-C 110.534 -0.173 . . . . 0.0 110.534 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 59.1 tp -60.38 -41.8 94.53 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 117.625 -1.178 . . . . 0.0 112.402 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.91 -49.73 71.5 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 120.098 1.317 . . . . 0.0 112.164 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.3 ttp-105 -59.94 -40.57 89.37 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 119.329 0.968 . . . . 0.0 112.338 176.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 7.2 t -69.96 -45.91 66.4 Favored 'General case' 0 C--O 1.222 -0.363 0 C-N-CA 125.176 1.39 . . . . 0.0 110.532 -179.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -57.08 -49.11 76.89 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 119.098 0.863 . . . . 0.0 111.591 174.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 87.3 mt -62.4 -41.44 98.66 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.378 1.071 . . . . 0.0 112.452 177.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.9 m -68.13 -42.63 79.91 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.153 0.981 . . . . 0.0 112.2 178.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 61.6 m -72.7 -28.63 62.79 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 178.146 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.38 -43.91 62.01 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.577 1.151 . . . . 0.0 112.453 173.326 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.2 m -69.67 -8.34 46.83 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.36 1.464 . . . . 0.0 114.521 -177.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 mt -115.44 -0.49 13.1 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.203 1.401 . . . . 0.0 111.834 178.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.42 25.47 21.07 Favored Glycine 0 CA--C 1.535 1.296 0 N-CA-C 116.313 1.285 . . . . 0.0 116.313 173.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -148.45 -173.8 4.43 Favored 'General case' 0 CA--C 1.553 1.062 0 CA-C-N 119.197 1.498 . . . . 0.0 114.043 -177.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 89.5 mt -92.85 162.5 14.07 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.948 1.699 . . . . 0.0 111.778 -178.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -123.47 144.96 15.89 Favored Glycine 0 CA--C 1.533 1.214 0 C-N-CA 124.945 1.26 . . . . 0.0 113.935 177.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.93 158.01 43.61 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 125.195 1.398 . . . . 0.0 112.372 170.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 18.5 t -89.62 137.91 31.93 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.281 -0.887 . . . . 0.0 110.843 171.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 56.3 mt -111.51 99.8 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 169.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.06 -73.46 0.18 Allowed Glycine 0 CA--C 1.531 1.079 0 C-N-CA 126.366 1.936 . . . . 0.0 114.289 178.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -138.17 13.95 2.83 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 127.05 2.14 . . . . 0.0 113.587 -173.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -150.52 146.38 26.56 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 120.2 -1.562 . . . . 0.0 112.727 -170.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 10.3 t -78.31 135.78 37.58 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.077 0.951 . . . . 0.0 111.534 174.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -138.56 146.88 42.38 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.469 1.508 . . . . 0.0 110.192 162.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.4 m -88.0 153.96 20.87 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.931 -0.481 . . . . 0.0 111.524 176.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.6 m -138.13 151.78 70.52 Favored Pre-proline 0 N--CA 1.473 0.713 0 C-N-CA 126.677 1.991 . . . . 0.0 111.561 -171.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -74.36 164.98 32.86 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 124.072 3.181 . . . . 0.0 113.695 -169.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 . . . . . 0 C--O 1.258 1.524 0 C-N-CA 125.12 1.368 . . . . 0.0 113.043 169.556 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 . . . . . 0 N--CA 1.469 0.509 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 29.6 tp -61.46 -41.15 96.79 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 118.3 -0.857 . . . . 0.0 112.139 -173.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.41 -37.41 87.18 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-N 119.798 1.181 . . . . 0.0 113.903 176.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 54.3 ttp180 -70.28 -39.61 74.8 Favored 'General case' 0 C--N 1.343 0.305 0 C-N-CA 125.304 1.441 . . . . 0.0 112.284 175.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 45.0 t -72.44 -38.55 68.29 Favored 'General case' 0 C--O 1.223 -0.341 0 C-N-CA 125.78 1.632 . . . . 0.0 111.151 179.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -56.33 -52.29 65.1 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 124.703 1.201 . . . . 0.0 110.595 175.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 44.8 mt -69.57 -37.57 77.05 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.604 0.762 . . . . 0.0 112.944 176.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 68.6 m -58.06 -41.05 82.52 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 121.817 -0.552 . . . . 0.0 111.694 171.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 83.6 m -75.76 -31.96 59.76 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 173.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.12 -35.59 73.72 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 120.63 -1.294 . . . . 0.0 112.261 172.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.2 t -60.5 -15.77 30.41 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.716 1.607 . . . . 0.0 113.991 173.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.8 mt -110.23 -6.9 14.93 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.297 1.439 . . . . 0.0 112.497 173.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.22 23.36 10.53 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 125.623 1.583 . . . . 0.0 116.604 174.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -144.82 -173.12 3.98 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 119.091 1.446 . . . . 0.0 113.749 -177.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 91.1 mt -92.77 159.3 15.47 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.444 1.498 . . . . 0.0 111.575 -176.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -116.06 148.63 18.89 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 124.199 0.904 . . . . 0.0 114.684 -178.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -135.83 150.1 49.29 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 127.918 2.487 . . . . 0.0 111.79 172.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 50.6 m -97.15 107.22 19.7 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 123.526 0.731 . . . . 0.0 109.324 168.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 45.6 mm -81.85 -177.26 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 164.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -53.52 101.73 0.09 OUTLIER Glycine 0 CA--C 1.534 1.274 0 O-C-N 120.513 -1.367 . . . . 0.0 112.956 -177.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 61.14 7.67 1.69 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 127.97 2.508 . . . . 0.0 116.185 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -137.15 147.89 46.26 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.883 1.673 . . . . 0.0 113.253 -175.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 43.0 t -76.85 141.85 40.47 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.058 1.343 . . . . 0.0 111.699 171.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.6 tppt? -144.9 148.89 34.41 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 127.964 2.506 . . . . 0.0 108.732 175.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 10.5 m -104.41 156.39 17.97 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.3 m -140.18 151.56 64.99 Favored Pre-proline 0 N--CA 1.472 0.654 0 C-N-CA 126.488 1.915 . . . . 0.0 111.485 -176.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.49 160.13 50.95 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 124.122 3.215 . . . . 0.0 113.315 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 . . . . . 0 C--O 1.255 1.38 0 C-N-CA 126.098 1.759 . . . . 0.0 113.767 172.51 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 . . . . . 0 CA--C 1.537 0.449 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.4 tp -57.87 -36.89 72.99 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 118.044 -0.979 . . . . 0.0 113.051 -175.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.0 -45.3 93.06 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 120.047 1.294 . . . . 0.0 112.646 173.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 21.7 ttm180 -65.78 -37.46 86.37 Favored 'General case' 0 C--N 1.346 0.414 0 C-N-CA 125.601 1.561 . . . . 0.0 113.054 175.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.6 t -72.44 -43.89 63.16 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 125.669 1.588 . . . . 0.0 110.064 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -59.82 -43.12 94.71 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.836 -0.54 . . . . 0.0 110.81 172.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 63.1 mt -64.72 -40.38 95.24 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.066 0.848 . . . . 0.0 113.157 173.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.4 m -68.59 -39.23 81.02 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.002 0.921 . . . . 0.0 111.1 -179.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.4 m -73.93 -30.08 62.37 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 171.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -62.63 -33.22 74.57 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.196 -1.565 . . . . 0.0 111.908 170.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 44.2 m -66.47 -11.87 54.44 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 170.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.1 mt -102.72 -19.49 14.73 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 120.458 1.481 . . . . 0.0 112.318 166.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 103.6 30.77 5.13 Favored Glycine 0 CA--C 1.538 1.474 0 C-N-CA 125.789 1.661 . . . . 0.0 115.376 177.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -150.36 -177.59 6.03 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.774 1.23 . . . . 0.0 113.409 178.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.7 tp -83.34 145.82 28.84 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.629 1.572 . . . . 0.0 111.577 -174.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -105.53 144.97 15.86 Favored Glycine 0 N--CA 1.472 1.081 0 C-N-CA 123.735 0.684 . . . . 0.0 113.452 175.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -137.76 151.54 48.27 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.203 1.801 . . . . 0.0 112.401 175.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 75.1 m -96.43 118.66 33.42 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 124.67 1.188 . . . . 0.0 109.787 170.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.6 mp -104.48 104.6 17.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 125.538 1.535 . . . . 0.0 107.116 178.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.65 -77.1 0.06 OUTLIER Glycine 0 CA--C 1.53 1.008 0 C-N-CA 125.29 1.424 . . . . 0.0 112.83 -167.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -142.64 0.8 1.29 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.724 1.609 . . . . 0.0 114.495 -177.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -128.03 150.26 50.01 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 119.593 1.088 . . . . 0.0 113.065 -177.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 45.0 t -77.85 134.58 37.93 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.761 1.624 . . . . 0.0 112.964 -175.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -141.62 165.88 26.28 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 127.982 2.513 . . . . 0.0 109.709 165.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.9 m -114.52 153.94 29.12 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 114.442 1.275 . . . . 0.0 114.442 -175.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.3 m -145.92 164.71 23.94 Favored Pre-proline 0 N--CA 1.485 1.309 0 C-N-CA 127.646 2.379 . . . . 0.0 111.665 -177.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -66.78 153.25 78.6 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.741 2.294 . . . . 0.0 113.077 172.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 . . . . . 0 C--O 1.25 1.084 0 C-N-CA 126.537 1.935 . . . . 0.0 113.255 177.443 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 . . . . . 0 CA--C 1.539 0.556 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 61.7 tp -49.38 -41.85 40.41 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.597 1.159 . . . . 0.0 111.904 172.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.31 -33.62 76.41 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 -176.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 60.1 ttt180 -78.62 -43.08 27.16 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 126.546 1.938 . . . . 0.0 111.125 175.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 25.1 t -71.07 -41.05 71.2 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 127.353 2.261 . . . . 0.0 112.087 -173.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -53.95 -45.28 71.24 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 119.239 0.927 . . . . 0.0 112.773 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.01 -35.24 61.99 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.781 1.232 . . . . 0.0 111.937 -178.079 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 69.2 m -71.72 -35.82 70.3 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.446 0.698 . . . . 0.0 112.755 173.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 81.1 m -71.52 -27.75 63.41 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 119.485 1.038 . . . . 0.0 113.145 172.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.36 -38.72 66.39 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.323 1.049 . . . . 0.0 113.755 -176.022 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 88.5 p -69.04 -11.85 61.16 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 -175.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.1 mt -108.23 1.74 22.27 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.203 1.401 . . . . 0.0 112.1 174.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.14 17.83 35.98 Favored Glycine 0 CA--C 1.535 1.283 0 C-N-CA 126.08 1.8 . . . . 0.0 116.372 170.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -136.76 -175.05 3.89 Favored 'General case' 0 CA--C 1.551 0.987 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 -171.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 70.1 mt -92.83 156.73 16.79 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 126.505 1.922 . . . . 0.0 111.148 -176.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -112.93 150.61 18.41 Favored Glycine 0 N--CA 1.472 1.058 0 C-N-CA 124.247 0.927 . . . . 0.0 114.311 176.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -142.76 154.54 44.35 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 127.956 2.502 . . . . 0.0 111.978 170.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -118.83 120.7 38.1 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.144 1.778 . . . . 0.0 111.452 -177.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.5 mp -141.93 128.33 19.2 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 125.627 1.571 . . . . 0.0 109.722 -177.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.94 44.07 94.64 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 124.396 0.998 . . . . 0.0 114.499 170.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.264 4.2 mm-40 62.42 20.54 11.95 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 126.535 1.934 . . . . 0.0 115.273 -175.359 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -131.75 142.9 49.9 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.603 -1.31 . . . . 0.0 113.055 173.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 10.2 t -76.84 134.39 39.06 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.805 1.242 . . . . 0.0 111.141 165.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.1 ttpt -138.83 138.4 37.48 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.641 1.176 . . . . 0.0 110.45 167.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.0 m -96.39 144.49 26.48 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.675 0.79 . . . . 0.0 112.083 -172.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.0 m -128.32 151.95 77.25 Favored Pre-proline 0 N--CA 1.473 0.683 0 C-N-CA 126.576 1.95 . . . . 0.0 112.093 -170.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.79 151.32 57.2 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.02 2.48 . . . . 0.0 112.625 -176.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 . . . . . 0 C--O 1.251 1.156 0 C-N-CA 124.119 0.967 . . . . 0.0 110.417 165.398 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 . . . . . 0 CA--C 1.535 0.374 0 N-CA-C 105.876 -1.898 . . . . 0.0 105.876 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 51.6 tp -57.53 -37.17 72.6 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.399 -0.81 . . . . 0.0 111.814 -176.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.61 -47.84 58.1 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.503 1.047 . . . . 0.0 112.663 -179.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.84 -43.31 76.9 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.195 1.398 . . . . 0.0 111.669 176.029 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.7 t -72.81 -50.94 21.03 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 126.959 2.103 . . . . 0.0 110.693 -178.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -53.32 -49.63 66.65 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.944 0.898 . . . . 0.0 111.457 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 87.4 mt -74.46 -34.31 63.12 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.476 1.11 . . . . 0.0 113.27 -175.101 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 37.7 m -66.82 -45.96 76.64 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.002 0.521 . . . . 0.0 110.659 170.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 73.0 m -58.96 -36.61 75.11 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 122.816 0.446 . . . . 0.0 111.599 171.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -34.43 71.85 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 120.623 -1.298 . . . . 0.0 113.422 175.663 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.8 p -66.11 -15.03 62.74 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 174.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.5 mt -102.59 -9.49 20.09 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.509 1.123 . . . . 0.0 112.023 170.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 120.42 -9.81 10.82 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 126.782 2.134 . . . . 0.0 116.354 172.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -125.59 -173.14 2.76 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 115.76 1.763 . . . . 0.0 115.76 -159.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 79.3 mt -94.01 161.69 14.19 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.222 1.409 . . . . 0.0 111.856 -175.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -118.12 137.6 13.2 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 125.343 1.449 . . . . 0.0 113.116 173.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.7 mptt -134.07 134.86 42.82 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 127.21 2.204 . . . . 0.0 110.66 174.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 29.1 m -75.08 151.68 38.63 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 121.745 0.783 . . . . 0.0 112.261 175.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 30.3 mt -123.83 75.63 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 126.445 1.898 . . . . 0.0 107.556 174.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.15 -96.61 0.14 Allowed Glycine 0 CA--C 1.531 1.07 0 CA-C-N 114.337 -1.301 . . . . 0.0 112.193 -170.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -98.5 -0.22 43.79 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.374 1.47 . . . . 0.0 114.578 -179.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -111.76 168.13 9.81 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 127.687 2.395 . . . . 0.0 111.071 177.718 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 9.2 t -146.13 138.11 25.08 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 120.704 -1.247 . . . . 0.0 114.231 167.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 33.7 mmtm -139.06 163.07 33.37 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 126.235 1.814 . . . . 0.0 110.861 -174.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 7.5 m -89.09 156.74 18.64 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -177.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.4 m -148.58 152.23 37.64 Favored Pre-proline 0 N--CA 1.466 0.359 0 C-N-CA 126.218 1.807 . . . . 0.0 111.92 -176.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -73.07 165.69 32.06 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.39 2.727 . . . . 0.0 112.273 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 . . . . . 0 C--O 1.249 1.068 0 C-N-CA 126.217 1.807 . . . . 0.0 112.272 -178.931 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 . . . . . 0 CA--C 1.534 0.356 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 65.4 tp -64.15 -37.64 88.2 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 117.891 -1.052 . . . . 0.0 112.999 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.39 -46.12 90.06 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 120.208 1.367 . . . . 0.0 111.542 178.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -65.85 -39.7 91.0 Favored 'General case' 0 C--N 1.346 0.441 0 C-N-CA 125.076 1.351 . . . . 0.0 112.841 173.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 19.7 t -63.13 -48.26 79.27 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 124.988 1.315 . . . . 0.0 110.124 178.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -59.88 -47.52 85.42 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.778 0.831 . . . . 0.0 111.104 175.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 51.4 mt -61.1 -44.48 97.29 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.968 0.804 . . . . 0.0 112.555 177.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 58.7 m -72.51 -41.03 66.38 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.163 0.985 . . . . 0.0 112.367 -178.224 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 77.0 m -64.33 -39.13 93.29 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.109 0.868 . . . . 0.0 110.992 172.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.1 ttm105 -67.02 -28.73 68.47 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.074 -1.016 . . . . 0.0 113.106 178.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 61.8 m -64.3 -11.14 28.93 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.614 1.339 . . . . 0.0 114.614 168.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.13 2.17 16.61 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 125.251 1.42 . . . . 0.0 112.18 170.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 90.94 18.37 47.51 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 126.074 1.797 . . . . 0.0 116.161 173.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -136.56 178.24 7.22 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 119.119 1.459 . . . . 0.0 114.344 -176.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -94.0 134.06 36.81 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.38 1.872 . . . . 0.0 111.718 -162.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -91.83 132.05 11.08 Favored Glycine 0 CA--C 1.532 1.114 0 CA-C-N 118.491 0.587 . . . . 0.0 113.821 179.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.5 tppt? -123.9 139.14 54.26 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 126.59 1.956 . . . . 0.0 111.56 176.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 7.1 t -105.6 125.63 51.21 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.989 0.915 . . . . 0.0 110.367 175.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.0 mt -118.51 82.79 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 125.302 1.441 . . . . 0.0 108.258 -177.016 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.57 -93.82 0.03 OUTLIER Glycine 0 CA--C 1.532 1.152 0 C-N-CA 125.229 1.395 . . . . 0.0 111.798 -167.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -96.49 -10.49 27.29 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.165 1.786 . . . . 0.0 114.819 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -105.0 147.6 27.62 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 120.52 1.509 . . . . 0.0 114.463 -175.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.4 t -106.52 121.33 44.08 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 124.817 1.247 . . . . 0.0 110.22 171.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -125.87 147.84 49.35 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 126.01 1.724 . . . . 0.0 109.971 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 6.9 m -107.49 143.69 35.5 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 122.792 0.437 . . . . 0.0 111.915 173.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.6 m -135.21 149.05 68.91 Favored Pre-proline 0 N--CA 1.474 0.769 0 C-N-CA 125.18 1.392 . . . . 0.0 112.603 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -82.84 58.74 6.51 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 124.468 3.446 . . . . 0.0 112.656 -170.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 . . . . . 0 C--O 1.252 1.199 0 C-N-CA 127.642 2.377 . . . . 0.0 114.171 -179.44 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 . . . . . 0 CA--C 1.535 0.381 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 41.8 tp -63.65 -33.21 75.11 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 118.232 -0.889 . . . . 0.0 112.657 -175.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.27 -44.66 78.77 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 119.52 1.055 . . . . 0.0 112.795 177.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -77.49 -29.91 52.79 Favored 'General case' 0 C--N 1.344 0.353 0 C-N-CA 124.148 0.979 . . . . 0.0 113.447 178.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.8 t -68.07 -44.26 76.73 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 124.965 1.306 . . . . 0.0 110.121 170.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -57.54 -47.35 82.24 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.879 0.763 . . . . 0.0 110.931 171.19 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.6 tt -57.32 -46.14 83.51 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.832 0.853 . . . . 0.0 111.239 176.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 48.8 m -70.35 -47.63 60.11 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.519 1.127 . . . . 0.0 112.82 -178.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 70.7 m -63.4 -42.88 98.8 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 118.639 0.654 . . . . 0.0 111.179 175.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.5 ttm-85 -74.2 -22.07 59.54 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.745 -1.222 . . . . 0.0 112.651 -177.078 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.8 m -72.19 -16.69 61.97 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 167.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.1 mt -89.53 -30.17 18.41 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.271 0.941 . . . . 0.0 111.333 163.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 128.28 12.88 2.73 Favored Glycine 0 CA--C 1.536 1.372 0 C-N-CA 125.672 1.606 . . . . 0.0 115.744 173.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -135.4 173.57 11.57 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 119.609 1.704 . . . . 0.0 114.595 -172.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.8 tp -84.87 135.85 33.9 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.379 1.471 . . . . 0.0 111.544 -167.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.58 137.99 15.86 Favored Glycine 0 CA--C 1.538 1.494 0 CA-C-N 118.725 0.693 . . . . 0.0 113.299 170.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.11 128.21 22.3 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.014 1.726 . . . . 0.0 113.878 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 6.7 t -91.63 133.42 35.58 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.265 1.426 . . . . 0.0 111.587 -179.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 13.1 mt -138.98 112.97 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.751 1.221 . . . . 0.0 110.396 -175.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.11 -100.76 0.43 Allowed Glycine 0 CA--C 1.53 1.017 0 N-CA-C 110.558 -1.017 . . . . 0.0 110.558 -168.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -126.99 7.95 6.69 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 126.671 1.988 . . . . 0.0 113.965 176.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -123.61 150.14 44.49 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.707 1.203 . . . . 0.0 110.258 -178.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.1 t -105.44 145.98 30.12 Favored 'General case' 0 CA--C 1.537 0.481 0 O-C-N 121.372 -0.83 . . . . 0.0 112.581 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -122.16 163.42 19.56 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 128.193 2.597 . . . . 0.0 109.839 174.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.9 m -106.34 149.18 27.21 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 122.056 -0.403 . . . . 0.0 111.598 163.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.2 m -142.4 156.09 64.03 Favored Pre-proline 0 N--CA 1.479 0.995 0 C-N-CA 124.999 1.32 . . . . 0.0 113.714 -172.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -84.5 51.55 3.3 Favored 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 124.987 3.791 . . . . 0.0 113.056 -172.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 . . . . . 0 C--O 1.252 1.229 0 C-N-CA 126.577 1.951 . . . . 0.0 113.604 -178.062 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 . . . . . 0 CA--C 1.534 0.361 0 N-CA-C 106.697 -1.594 . . . . 0.0 106.697 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 29.7 tp -59.22 -40.86 87.18 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.754 1.161 . . . . 0.0 112.438 -173.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.7 -48.49 81.54 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 119.488 1.04 . . . . 0.0 112.433 178.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -60.07 -43.42 95.47 Favored 'General case' 0 C--N 1.346 0.432 0 C-N-CA 125.645 1.578 . . . . 0.0 112.832 172.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 7.9 t -77.38 -43.38 32.96 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 124.986 1.314 . . . . 0.0 111.44 -169.58 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -58.72 -44.49 90.43 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.823 1.192 . . . . 0.0 111.162 171.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 79.1 mt -64.55 -38.5 91.22 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 175.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 63.0 m -79.1 -32.38 44.6 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.763 1.225 . . . . 0.0 113.116 -179.24 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 58.6 m -73.33 -27.29 61.44 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 119.009 -0.519 . . . . 0.0 111.129 169.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -35.79 75.33 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 119.836 1.198 . . . . 0.0 112.944 167.658 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.7 m -63.51 -19.94 65.19 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.222 1.009 . . . . 0.0 113.083 174.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 21.0 mt -100.2 -27.24 13.62 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.28 1.432 . . . . 0.0 112.349 172.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 105.33 17.97 12.83 Favored Glycine 0 CA--C 1.539 1.59 0 C-N-CA 126.199 1.857 . . . . 0.0 115.911 178.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -134.56 -177.56 4.66 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.382 1.591 . . . . 0.0 113.13 -175.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 30.3 tp -91.27 140.83 29.42 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.121 1.768 . . . . 0.0 112.706 -165.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -92.14 141.71 15.72 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 124.817 1.199 . . . . 0.0 115.938 -178.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.3 tppt? -143.53 173.62 11.48 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 128.054 2.542 . . . . 0.0 112.927 176.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 35.8 t -126.2 144.73 50.66 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.526 1.53 . . . . 0.0 110.864 174.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 55.6 mt -135.54 118.16 22.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 124.288 1.035 . . . . 0.0 108.348 166.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.23 -79.92 0.63 Allowed Glycine 0 N--CA 1.472 1.055 0 C-N-CA 124.327 0.965 . . . . 0.0 114.412 171.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -150.83 18.42 0.79 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 127.833 2.453 . . . . 0.0 112.003 176.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -120.45 145.37 47.31 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.429 2.292 . . . . 0.0 112.663 -177.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 2.1 t -83.88 132.36 34.8 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 124.946 1.298 . . . . 0.0 110.06 169.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -136.31 131.4 34.3 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.75 1.22 . . . . 0.0 110.319 -177.594 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 6.3 m -99.19 144.27 28.51 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.182 0.593 . . . . 0.0 111.796 177.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.0 m -134.65 155.19 79.72 Favored Pre-proline 0 N--CA 1.474 0.756 0 C-N-CA 125.921 1.689 . . . . 0.0 112.702 -177.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -71.38 161.99 43.81 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.719 2.946 . . . . 0.0 112.659 174.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 83.7 m-85 . . . . . 0 C--O 1.251 1.143 0 C-N-CA 125.421 1.488 . . . . 0.0 114.065 -176.238 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 55.2 t-20 . . . . . 0 CA--C 1.536 0.406 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 42.3 tp -52.26 -41.12 62.55 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.071 0.948 . . . . 0.0 112.647 177.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.25 90.27 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 118.939 0.79 . . . . 0.0 112.91 -177.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 59.7 ttt180 -71.42 -43.21 67.18 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.701 1.6 . . . . 0.0 111.401 174.277 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 19.7 t -68.46 -40.06 81.19 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 126.442 1.897 . . . . 0.0 112.007 -176.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -60.05 -44.11 94.9 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.802 0.728 . . . . 0.0 112.299 178.379 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -74.16 -33.98 63.68 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.75 0.82 . . . . 0.0 112.448 177.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 28.4 m -65.49 -47.28 76.59 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 121.601 -0.687 . . . . 0.0 111.87 172.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.2 m -70.81 -34.54 71.84 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 118.735 0.698 . . . . 0.0 112.594 177.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 41.9 ttm180 -54.91 -34.35 63.04 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 121.289 -0.882 . . . . 0.0 111.161 168.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.3 m -77.54 0.58 22.4 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 176.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.2 mt -115.92 -3.83 12.12 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 125.278 1.431 . . . . 0.0 112.075 165.119 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.43 19.02 31.23 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 125.733 1.635 . . . . 0.0 116.383 175.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -143.78 -172.05 3.66 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.367 1.467 . . . . 0.0 112.89 -179.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 20.5 tp -94.25 150.77 19.99 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.461 1.504 . . . . 0.0 111.901 -168.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -106.04 142.81 15.65 Favored Glycine 0 CA--C 1.532 1.113 0 O-C-N 121.424 -0.797 . . . . 0.0 114.523 177.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -142.64 160.94 39.32 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 128.031 2.532 . . . . 0.0 111.036 169.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 4.7 t -97.44 138.09 35.42 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.762 -0.586 . . . . 0.0 111.387 167.006 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 55.1 mt -126.49 116.04 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 125.358 1.463 . . . . 0.0 108.848 168.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.41 -96.65 0.15 Allowed Glycine 0 CA--C 1.532 1.127 0 C-N-CA 125.064 1.316 . . . . 0.0 112.453 -176.101 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -125.33 18.89 8.23 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 125.956 1.702 . . . . 0.0 113.62 178.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -129.61 145.27 51.5 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.295 1.438 . . . . 0.0 112.861 -174.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 9.6 t -74.95 128.11 34.79 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.231 0.613 . . . . 0.0 109.84 160.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -130.45 132.7 45.83 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.306 1.442 . . . . 0.0 108.776 174.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 22.5 m -92.84 139.7 30.27 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 120.787 0.327 . . . . 0.0 111.687 -177.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.7 m -127.34 152.69 76.61 Favored Pre-proline 0 N--CA 1.469 0.517 0 C-N-CA 126.011 1.725 . . . . 0.0 110.984 -168.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -63.24 158.93 41.83 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.287 2.658 . . . . 0.0 112.365 -177.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 . . . . . 0 C--O 1.253 1.262 0 C-N-CA 124.576 1.151 . . . . 0.0 109.765 159.591 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.714 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 77.6 p -66.95 -22.56 65.93 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 118.529 1.165 . . . . 0.0 112.091 169.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -126.8 158.37 36.76 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 126.613 1.965 . . . . 0.0 109.539 170.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -144.96 103.59 3.9 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.71 1.204 . . . . 0.0 111.024 176.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 50.2 t -62.72 143.8 57.06 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.38 0.672 . . . . 0.0 111.597 170.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -119.54 115.4 23.95 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.09 1.756 . . . . 0.0 108.339 172.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 53.9 tp -58.26 -45.25 88.16 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-O 117.909 -1.043 . . . . 0.0 112.316 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.2 -39.81 79.92 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 120.208 1.367 . . . . 0.0 112.957 175.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 32.5 ttp180 -78.16 -33.94 49.97 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.291 1.437 . . . . 0.0 113.379 -179.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 35.6 t -69.19 -40.82 77.82 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 126.062 1.745 . . . . 0.0 109.933 171.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -61.64 -44.72 96.45 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.291 1.037 . . . . 0.0 111.639 175.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 26.8 mt -66.77 -28.72 68.62 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.177 1.391 . . . . 0.0 113.62 173.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 63.1 m -77.93 -47.78 17.83 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.729 1.212 . . . . 0.0 112.085 175.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 68.4 m -67.49 -31.6 71.85 Favored 'General case' 0 CA--C 1.549 0.91 0 O-C-N 121.248 -0.908 . . . . 0.0 111.774 178.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 42.4 ttm-85 -53.64 -32.95 53.5 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.529 1.532 . . . . 0.0 112.964 166.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.0 m -71.46 -16.74 62.38 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 114.301 1.222 . . . . 0.0 114.301 177.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.1 mt -108.27 -11.06 15.28 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.401 1.08 . . . . 0.0 112.459 175.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 98.42 27.19 8.77 Favored Glycine 0 CA--C 1.537 1.407 0 C-N-CA 125.621 1.581 . . . . 0.0 115.635 174.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -145.28 178.64 7.94 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 119.232 1.516 . . . . 0.0 112.725 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.3 tp -86.78 148.57 25.35 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.913 1.285 . . . . 0.0 111.639 -170.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -100.09 143.24 16.28 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 123.915 0.769 . . . . 0.0 114.099 173.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.13 157.4 44.93 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 127.344 2.258 . . . . 0.0 110.474 169.281 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 85.7 m -100.19 133.71 44.18 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.417 -0.802 . . . . 0.0 110.533 171.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 71.6 mt -138.5 125.14 25.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.181 1.393 . . . . 0.0 108.617 177.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.63 33.2 76.21 Favored Glycine 0 CA--C 1.539 1.552 0 O-C-N 121.487 -0.758 . . . . 0.0 114.265 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 60.72 21.11 11.13 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 127.043 2.137 . . . . 0.0 114.907 -172.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -120.72 152.5 38.19 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.156 1.783 . . . . 0.0 110.953 173.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 33.2 t -76.75 131.02 38.5 Favored 'General case' 0 C--O 1.241 0.657 0 O-C-N 121.593 -0.692 . . . . 0.0 110.525 176.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 42.9 tttt -139.35 127.61 22.67 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.729 1.212 . . . . 0.0 109.974 175.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 12.5 m -89.79 151.79 21.62 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.606 -177.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.4 m -141.05 150.55 59.47 Favored Pre-proline 0 N--CA 1.474 0.737 0 C-N-CA 124.883 1.273 . . . . 0.0 113.112 -175.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -79.19 65.89 8.82 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 124.66 3.574 . . . . 0.0 112.845 -175.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 . . . . . 0 C--O 1.253 1.261 0 C-N-CA 128.404 2.682 . . . . 0.0 114.159 -179.932 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.14 0 N-CA-C 112.067 -0.413 . . . . 0.0 112.067 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.5 t -148.9 23.26 0.97 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.448 1.099 . . . . 0.0 113.561 176.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -84.6 7.07 21.43 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 115.985 1.846 . . . . 0.0 115.985 -165.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 31.4 t80 46.35 48.09 13.6 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 125.356 1.463 . . . . 0.0 111.884 -167.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.5 t -80.27 142.18 34.82 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 126.038 1.735 . . . . 0.0 112.098 -167.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -141.35 150.77 42.87 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.308 1.443 . . . . 0.0 108.674 167.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 44.4 tp -53.91 -40.53 66.76 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 119.275 0.943 . . . . 0.0 112.001 167.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.29 -42.07 84.35 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.703 1.138 . . . . 0.0 112.981 177.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 31.8 mtp180 -69.13 -36.25 77.27 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.658 1.183 . . . . 0.0 112.386 177.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 16.0 t -78.0 -36.38 48.87 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 125.694 1.598 . . . . 0.0 110.854 178.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -55.09 -47.61 74.7 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.58 0.752 . . . . 0.0 111.258 167.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 53.5 mt -63.14 -50.73 69.27 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.222 0.609 . . . . 0.0 111.884 174.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 44.4 m -64.02 -43.51 95.37 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -176.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 78.6 m -65.44 -35.17 80.12 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.189 0.904 . . . . 0.0 112.631 173.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 26.4 ttm105 -69.77 -19.59 63.51 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 120.994 -1.066 . . . . 0.0 113.046 178.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.2 p -62.92 -31.1 72.1 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 118.569 0.622 . . . . 0.0 112.511 166.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 mt -91.31 -6.04 53.73 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.531 1.132 . . . . 0.0 112.555 173.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.24 12.46 39.07 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 126.623 2.059 . . . . 0.0 115.916 174.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -134.79 -177.71 4.75 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 120.08 1.94 . . . . 0.0 113.473 -175.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 80.6 mt -94.14 164.03 13.22 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.6 1.16 . . . . 0.0 111.894 -169.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -117.3 146.54 18.78 Favored Glycine 0 N--CA 1.474 1.225 0 N-CA-C 116.119 1.208 . . . . 0.0 116.119 -171.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 57.4 mmtt -133.9 134.38 42.6 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 127.348 2.259 . . . . 0.0 111.664 165.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 53.6 t -114.0 109.53 18.61 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.916 1.286 . . . . 0.0 109.925 -177.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 36.9 mm -140.14 127.06 23.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 124.475 1.11 . . . . 0.0 109.723 -167.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.29 29.72 75.8 Favored Glycine 0 CA--C 1.536 1.371 0 CA-C-O 119.379 -0.678 . . . . 0.0 114.609 177.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 62.46 29.32 17.11 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.933 1.693 . . . . 0.0 114.484 -175.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -135.41 155.03 51.22 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.569 1.948 . . . . 0.0 109.917 168.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 10.0 t -107.77 135.38 49.29 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.32 1.048 . . . . 0.0 112.321 -175.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 66.1 mmtt -136.83 153.62 50.74 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 127.156 2.182 . . . . 0.0 111.307 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 12.3 m -115.95 149.35 38.89 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 -174.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.3 m -138.6 156.97 72.9 Favored Pre-proline 0 N--CA 1.481 1.087 0 C-N-CA 127.051 2.14 . . . . 0.0 113.07 -170.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -83.44 165.37 14.34 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 124.069 3.179 . . . . 0.0 114.684 -173.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 . . . . . 0 C--O 1.256 1.402 0 C-N-CA 125.53 1.532 . . . . 0.0 112.012 167.595 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.12 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.4 m -100.82 -10.5 20.67 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.833 1.42 . . . . 0.0 114.833 -173.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 57.75 139.95 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 118.426 2.75 . . . . 0.0 118.426 178.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.1 t80 43.21 66.34 0.81 Allowed 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 127.566 2.346 . . . . 0.0 113.999 164.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 11.5 t -67.33 128.64 37.17 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.547 -0.751 . . . . 0.0 112.435 -165.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 45.3 t30 -115.42 114.04 24.54 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.425 1.09 . . . . 0.0 110.225 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 46.7 tp -57.67 -34.44 69.39 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 118.719 -0.658 . . . . 0.0 112.137 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.23 -46.63 87.96 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 118.975 0.807 . . . . 0.0 112.686 176.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 18.7 ttt180 -66.12 -45.02 82.59 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 126.038 1.735 . . . . 0.0 111.994 175.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 49.7 t -65.55 -44.66 86.15 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 125.402 1.481 . . . . 0.0 111.222 -176.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -54.64 -52.02 63.6 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.562 0.745 . . . . 0.0 111.16 176.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 16.6 tp -73.76 -28.25 61.58 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.662 1.185 . . . . 0.0 113.299 -176.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.4 m -73.4 -47.53 41.19 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.678 0.791 . . . . 0.0 110.867 173.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 95.7 m -60.89 -31.55 71.04 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 171.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -52.82 -32.2 42.96 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.355 1.062 . . . . 0.0 113.649 173.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 54.6 p -63.58 -24.27 67.73 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.3 mt -97.71 -8.75 27.99 Favored 'General case' 0 N--CA 1.477 0.903 0 O-C-N 121.047 -1.033 . . . . 0.0 112.22 174.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 111.47 6.6 25.2 Favored Glycine 0 CA--C 1.532 1.156 0 C-N-CA 126.716 2.103 . . . . 0.0 115.586 172.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -130.01 -172.04 2.68 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 119.972 1.886 . . . . 0.0 114.953 -167.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.2 mt -92.9 157.69 16.23 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.306 1.442 . . . . 0.0 111.203 -176.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -110.39 147.96 17.49 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 124.911 1.243 . . . . 0.0 113.941 174.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -134.23 148.68 50.89 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 126.948 2.099 . . . . 0.0 111.184 167.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.6 m -108.93 125.33 51.91 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.019 1.328 . . . . 0.0 111.1 175.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 mp -131.42 113.35 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 124.898 1.279 . . . . 0.0 110.145 177.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.68 -94.35 0.16 Allowed Glycine 0 CA--C 1.529 0.955 0 C-N-CA 124.139 0.876 . . . . 0.0 111.888 -177.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -114.74 -11.04 12.35 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.809 2.043 . . . . 0.0 113.657 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -112.82 139.88 48.08 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.298 1.039 . . . . 0.0 113.138 -164.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 16.8 t -85.75 122.41 29.8 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 125.168 1.387 . . . . 0.0 109.404 164.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -121.5 143.58 49.19 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.524 1.53 . . . . 0.0 109.117 172.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 10.7 m -99.2 149.35 23.17 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -178.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.9 m -140.92 152.26 64.87 Favored Pre-proline 0 N--CA 1.477 0.893 0 C-N-CA 125.032 1.333 . . . . 0.0 113.772 -174.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -70.58 170.28 17.94 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 124.221 3.281 . . . . 0.0 112.978 176.217 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 . . . . . 0 C--O 1.251 1.166 0 C-N-CA 125.015 1.326 . . . . 0.0 112.349 176.115 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.12 0 CA-C-O 119.56 -0.578 . . . . 0.0 111.756 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.0 p -91.51 -18.13 24.61 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 115.714 1.746 . . . . 0.0 115.714 -164.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -157.12 165.92 34.7 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.915 1.286 . . . . 0.0 111.108 -175.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -132.22 80.06 1.89 Allowed 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.141 1.376 . . . . 0.0 112.979 -169.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 35.8 t -78.81 144.73 34.8 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.42 -0.8 . . . . 0.0 111.992 173.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -133.55 131.65 39.98 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 124.519 1.128 . . . . 0.0 110.6 172.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 36.4 tp -58.17 -35.68 71.93 Favored 'General case' 0 C--O 1.223 -0.326 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 -177.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.43 -45.12 63.49 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 120.327 1.421 . . . . 0.0 111.704 176.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 21.1 ttm180 -63.05 -36.08 82.39 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.364 1.465 . . . . 0.0 112.926 177.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 28.1 t -77.75 -41.27 38.19 Favored 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 126.854 2.062 . . . . 0.0 111.03 176.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -58.77 -48.77 80.07 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.165 0.893 . . . . 0.0 111.023 171.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 75.3 mt -63.36 -37.32 86.82 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.704 0.802 . . . . 0.0 112.467 177.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 62.9 m -65.75 -51.11 61.89 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.329 0.651 . . . . 0.0 111.821 174.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.2 m -69.83 -35.44 74.77 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -179.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 36.1 ttm105 -65.85 -25.02 67.01 Favored 'General case' 0 N--CA 1.481 1.106 0 O-C-N 120.846 -1.159 . . . . 0.0 113.078 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.6 p -67.63 -15.65 63.76 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 169.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -104.95 -4.78 21.69 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 125.649 1.579 . . . . 0.0 112.306 175.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 97.44 17.31 31.73 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 126.511 2.005 . . . . 0.0 116.348 176.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -143.13 177.16 8.57 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 119.439 1.619 . . . . 0.0 113.365 -178.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.8 tp -91.23 145.78 24.38 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.196 0.998 . . . . 0.0 111.602 -169.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -99.77 141.68 15.59 Favored Glycine 0 N--CA 1.473 1.103 0 O-C-N 121.644 -0.66 . . . . 0.0 113.573 178.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -148.2 126.94 12.57 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 126.409 1.884 . . . . 0.0 109.01 -176.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 56.7 m -82.27 133.69 35.25 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.147 -0.971 . . . . 0.0 110.819 -177.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 50.5 mt -125.22 118.57 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 123.815 0.846 . . . . 0.0 109.096 175.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 68.67 -83.39 0.21 Allowed Glycine 0 CA--C 1.524 0.643 0 C-N-CA 125.709 1.623 . . . . 0.0 111.742 -176.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -143.1 3.1 1.35 Allowed 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.075 1.75 . . . . 0.0 112.831 -176.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -133.88 158.38 43.58 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.556 1.542 . . . . 0.0 112.751 -172.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 41.4 t -87.51 130.28 34.77 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.737 1.215 . . . . 0.0 112.479 -175.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -127.66 159.8 33.58 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 127.14 2.176 . . . . 0.0 109.744 172.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 8.3 m -122.59 141.53 51.6 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -176.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.5 m -133.52 157.89 76.92 Favored Pre-proline 0 N--CA 1.475 0.78 0 C-N-CA 126.702 2.001 . . . . 0.0 112.694 -167.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.5 154.73 68.38 Favored 'Trans proline' 0 C--O 1.241 0.643 0 C-N-CA 123.367 2.711 . . . . 0.0 112.454 171.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 . . . . . 0 C--O 1.252 1.225 0 C-N-CA 126.292 1.837 . . . . 0.0 112.528 175.209 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.184 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 89.8 p -164.38 150.7 10.92 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.937 1.695 . . . . 0.0 110.332 179.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -133.77 31.49 3.64 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 129.1 2.96 . . . . 0.0 112.54 6.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 71.0 t80 48.62 117.97 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 128.331 2.652 . . . . 0.0 115.215 -166.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 25.7 t -90.16 119.26 30.34 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 120.62 -1.3 . . . . 0.0 112.064 -179.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -99.7 119.86 38.78 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 126.932 2.093 . . . . 0.0 107.604 168.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.5 tp -62.8 -35.7 80.74 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-O 117.973 -1.013 . . . . 0.0 112.555 -175.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.74 -45.57 82.12 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 120.117 1.326 . . . . 0.0 111.998 173.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -60.41 -44.71 95.45 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 123.926 0.89 . . . . 0.0 111.465 176.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 33.9 t -68.66 -43.69 75.66 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 124.916 1.286 . . . . 0.0 110.946 178.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -53.84 -52.52 60.12 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 124.015 0.926 . . . . 0.0 110.545 176.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 75.7 mt -75.07 -37.64 61.55 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.435 1.094 . . . . 0.0 113.439 -176.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.9 m -60.17 -41.17 92.29 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.0 0.818 . . . . 0.0 111.182 170.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 73.8 m -71.66 -33.11 68.6 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 171.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.55 -35.7 76.67 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 120.74 -1.225 . . . . 0.0 112.382 178.277 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.6 m -62.48 -6.82 3.69 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 174.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -115.3 -3.57 12.47 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 125.476 1.511 . . . . 0.0 113.391 174.199 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.26 29.7 8.75 Favored Glycine 0 CA--C 1.541 1.675 0 C-N-CA 125.028 1.299 . . . . 0.0 116.17 175.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -150.89 -173.02 4.36 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.413 1.485 . . . . 0.0 112.026 178.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 11.1 mp -105.05 156.67 17.84 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.599 1.159 . . . . 0.0 111.726 -175.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -112.02 139.98 15.92 Favored Glycine 0 CA--C 1.525 0.675 0 C-N-CA 124.99 1.281 . . . . 0.0 113.155 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -131.12 149.78 52.44 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 126.593 1.957 . . . . 0.0 110.564 177.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 27.4 m -101.28 129.38 47.24 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 124.101 0.96 . . . . 0.0 111.98 -174.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 25.2 mt -128.35 90.74 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 124.908 1.283 . . . . 0.0 109.152 -174.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.76 -73.77 0.25 Allowed Glycine 0 CA--C 1.534 1.272 0 C-N-CA 125.964 1.745 . . . . 0.0 114.452 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -135.18 -2.75 2.5 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.684 1.994 . . . . 0.0 112.752 176.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -108.14 153.94 22.43 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 127.437 2.295 . . . . 0.0 111.32 -173.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 11.7 t -106.05 130.42 53.97 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.469 1.508 . . . . 0.0 110.064 171.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.4 mptt -126.99 148.36 50.1 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.201 1.801 . . . . 0.0 110.418 175.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 10.3 m -110.0 124.95 52.35 Favored 'General case' 0 C--O 1.238 0.48 0 C-N-CA 123.818 0.847 . . . . 0.0 111.742 -178.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.0 m -99.21 144.91 29.11 Favored Pre-proline 0 N--CA 1.471 0.607 0 C-N-CA 126.008 1.723 . . . . 0.0 113.493 -167.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -74.99 117.87 5.07 Favored 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 123.091 2.527 . . . . 0.0 115.048 -153.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 . . . . . 0 C--O 1.256 1.43 0 C-N-CA 126.856 2.062 . . . . 0.0 112.554 170.059 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.18 0 N-CA-C 111.951 -0.46 . . . . 0.0 111.951 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.5 -26.22 59.86 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.193 0.997 . . . . 0.0 112.558 170.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -150.89 176.95 10.6 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 127.613 2.365 . . . . 0.0 108.66 166.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 11.6 p90 -141.79 139.13 32.69 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 125.062 1.345 . . . . 0.0 109.99 170.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 30.0 t -86.99 141.59 28.56 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.605 1.562 . . . . 0.0 110.333 171.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -107.12 113.72 27.34 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.838 0.855 . . . . 0.0 109.251 173.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.1 tp -67.69 -32.52 73.24 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-O 118.552 -0.737 . . . . 0.0 111.884 -174.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.36 -43.53 98.6 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 119.37 0.986 . . . . 0.0 111.895 174.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 32.7 ttp85 -70.98 -36.1 72.38 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 125.38 1.472 . . . . 0.0 112.803 177.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 37.7 t -73.33 -39.69 65.05 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 126.003 1.721 . . . . 0.0 111.119 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -57.98 -52.1 66.92 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 123.43 0.692 . . . . 0.0 109.867 171.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 76.4 mt -59.31 -41.21 88.51 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 119.275 0.943 . . . . 0.0 112.639 174.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.2 m -64.03 -47.37 80.51 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.861 0.865 . . . . 0.0 112.369 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 93.7 m -73.01 -37.23 67.03 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 177.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 40.8 ttm-85 -70.3 -23.47 62.86 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.696 1.198 . . . . 0.0 112.239 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.6 m -63.3 -17.35 62.44 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.26 1.024 . . . . 0.0 113.672 166.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.07 -0.19 25.02 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 126.195 1.798 . . . . 0.0 112.547 173.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.86 26.86 30.63 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 125.266 1.412 . . . . 0.0 116.169 175.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -144.63 -179.69 6.73 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.651 1.581 . . . . 0.0 113.092 176.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 21.6 tp -88.19 141.49 28.52 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.581 1.552 . . . . 0.0 111.745 -167.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -93.56 141.88 15.74 Favored Glycine 0 CA--C 1.532 1.135 0 O-C-N 121.931 -0.481 . . . . 0.0 113.82 174.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -138.72 151.56 47.25 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.819 2.048 . . . . 0.0 111.758 172.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 33.6 m -103.18 114.26 28.41 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.75 1.22 . . . . 0.0 110.094 174.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 51.5 mt -141.24 107.8 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 124.92 1.288 . . . . 0.0 110.699 -173.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.7 51.28 5.23 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 124.9 1.238 . . . . 0.0 113.282 177.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 79.3 mt-10 57.7 10.43 1.05 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 126.252 1.821 . . . . 0.0 114.655 -171.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -133.7 154.73 50.72 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.859 1.663 . . . . 0.0 112.755 -168.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 40.0 t -83.07 135.86 34.68 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.39 1.076 . . . . 0.0 111.611 175.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 30.7 tptt -142.51 146.88 35.16 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.968 1.707 . . . . 0.0 110.746 176.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.0 m -105.56 144.13 32.75 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.8 m -135.35 156.02 78.23 Favored Pre-proline 0 N--CA 1.474 0.77 0 C-N-CA 126.285 1.834 . . . . 0.0 110.916 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -63.13 155.03 63.72 Favored 'Trans proline' 0 CA--C 1.536 0.58 0 C-N-CA 122.568 2.178 . . . . 0.0 112.245 173.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 . . . . . 0 C--O 1.251 1.149 0 C-N-CA 124.194 0.998 . . . . 0.0 111.561 171.507 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.932 0 N-CA-C 110.353 -1.099 . . . . 0.0 110.353 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.5 m -85.55 4.87 34.02 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -173.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 54.32 5.27 0.08 Allowed 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 119.503 3.149 . . . . 0.0 119.503 177.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -145.53 76.42 1.47 Allowed 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 120.917 1.69 . . . . 0.0 114.492 -171.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 36.5 t -139.13 141.48 38.08 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.266 -0.896 . . . . 0.0 112.607 163.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -123.51 130.92 53.39 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.695 1.598 . . . . 0.0 108.623 166.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 42.8 tp -61.76 -38.16 86.96 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 117.924 -1.036 . . . . 0.0 113.0 -175.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -69.35 -38.11 77.98 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 120.569 1.532 . . . . 0.0 112.448 176.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.5 tmm_? -61.96 -38.89 90.24 Favored 'General case' 0 C--N 1.344 0.369 0 C-N-CA 124.633 1.173 . . . . 0.0 112.999 172.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 34.4 t -77.76 -38.73 46.24 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 125.313 1.445 . . . . 0.0 111.404 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -62.31 -45.49 93.03 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.518 0.599 . . . . 0.0 110.294 177.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 39.0 tp -62.16 -44.36 96.78 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.722 1.209 . . . . 0.0 112.506 172.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.8 m -60.64 -50.3 74.08 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 122.791 0.437 . . . . 0.0 110.934 178.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 80.5 m -66.25 -34.97 79.22 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 177.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 55.3 ttm-85 -58.06 -38.01 75.5 Favored 'General case' 0 N--CA 1.479 0.984 0 O-C-N 120.877 -1.14 . . . . 0.0 111.985 173.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 21.2 p -63.01 -17.51 62.28 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 176.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 mt -102.39 -10.68 19.24 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.773 1.229 . . . . 0.0 112.603 176.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 106.32 20.0 9.5 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 125.755 1.645 . . . . 0.0 116.399 176.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -149.49 -173.19 4.33 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 119.465 1.633 . . . . 0.0 113.169 -177.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 26.2 tp -98.25 157.93 15.87 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.256 1.422 . . . . 0.0 111.732 -174.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -116.93 147.98 18.88 Favored Glycine 0 N--CA 1.471 1.032 0 N-CA-C 115.251 0.861 . . . . 0.0 115.251 -178.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -136.43 153.3 51.11 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 128.168 2.587 . . . . 0.0 110.854 171.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 50.5 m -98.67 115.14 28.03 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.638 1.175 . . . . 0.0 109.566 171.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.6 mm -127.77 119.87 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 125.725 1.61 . . . . 0.0 108.965 -176.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.22 40.88 92.42 Favored Glycine 0 CA--C 1.533 1.194 0 C-N-CA 123.631 0.634 . . . . 0.0 113.113 -173.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 49.32 30.87 3.42 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 127.41 2.284 . . . . 0.0 115.52 -170.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -128.09 151.78 48.78 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.796 1.638 . . . . 0.0 110.144 171.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 53.4 t -75.52 137.49 40.91 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.468 -0.77 . . . . 0.0 111.136 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -147.92 130.44 15.83 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 127.291 2.237 . . . . 0.0 109.057 -173.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 13.2 m -107.48 146.58 31.59 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 122.581 1.182 . . . . 0.0 113.755 -171.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.7 m -138.5 156.94 73.07 Favored Pre-proline 0 N--CA 1.476 0.862 0 C-N-CA 126.703 2.001 . . . . 0.0 111.733 -172.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -64.91 144.49 83.08 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.677 2.251 . . . . 0.0 111.008 169.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 52.3 m-85 . . . . . 0 C--O 1.256 1.434 0 C-N-CA 125.288 1.435 . . . . 0.0 113.177 -178.649 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.108 0 CA-C-O 121.03 0.239 . . . . 0.0 112.614 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 78.2 p -142.56 2.79 1.44 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.666 1.987 . . . . 0.0 114.642 -171.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 57.03 64.14 1.72 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.968 1.707 . . . . 0.0 112.375 -173.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.8 t80 59.6 110.83 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 127.393 2.277 . . . . 0.0 113.264 -165.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 29.6 t -57.15 134.34 55.79 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.315 1.446 . . . . 0.0 111.748 -175.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 62.8 t-20 -86.52 109.82 19.36 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 124.171 0.988 . . . . 0.0 109.997 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.8 tp -57.89 -34.96 70.37 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-O 117.763 -1.113 . . . . 0.0 112.74 176.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.88 -38.12 89.92 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 120.439 1.472 . . . . 0.0 112.675 177.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.9 ttm105 -78.84 -28.64 44.34 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 120.88 -1.138 . . . . 0.0 113.058 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 32.5 t -73.11 -41.62 63.83 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 125.372 1.469 . . . . 0.0 109.995 172.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -57.87 -46.2 85.21 Favored 'General case' 0 C--O 1.221 -0.409 0 C-N-CA 124.922 1.289 . . . . 0.0 110.0 174.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 39.0 tp -62.51 -50.72 70.26 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.232 1.013 . . . . 0.0 112.041 173.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 72.8 m -56.82 -37.87 71.81 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.378 1.071 . . . . 0.0 112.359 -179.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 68.8 m -85.12 -37.42 20.26 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 112.994 0.738 . . . . 0.0 112.994 178.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 28.9 ttm105 -64.55 -28.82 69.9 Favored 'General case' 0 N--CA 1.479 1.022 0 O-C-N 120.978 -1.076 . . . . 0.0 112.543 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.3 m -62.08 -24.62 67.22 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 170.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mt -96.31 -9.66 29.65 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.373 0.988 . . . . 0.0 112.299 176.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 101.19 20.42 13.85 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 125.391 1.472 . . . . 0.0 115.77 176.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -138.16 -173.25 3.47 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.816 1.646 . . . . 0.0 111.679 176.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 79.2 mt -103.93 161.77 13.69 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.334 1.053 . . . . 0.0 112.801 -170.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -96.2 151.97 20.09 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 124.348 0.975 . . . . 0.0 114.037 179.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.1 tptt -143.1 124.0 14.31 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 126.99 2.116 . . . . 0.0 110.371 173.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.6 m -100.02 122.03 42.28 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 123.555 0.742 . . . . 0.0 110.003 176.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.4 mp -115.58 99.66 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 176.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.48 -94.61 0.03 OUTLIER Glycine 0 CA--C 1.531 1.078 0 C-N-CA 125.84 1.686 . . . . 0.0 113.624 -176.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -104.16 -3.87 23.86 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.11 1.364 . . . . 0.0 114.475 -173.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -139.6 152.34 46.74 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 120.459 1.481 . . . . 0.0 113.602 -175.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 14.5 t -92.66 135.85 33.74 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.989 2.115 . . . . 0.0 112.703 -179.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -122.33 156.83 33.08 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 128.835 2.854 . . . . 0.0 109.23 171.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 28.8 m -112.14 141.37 45.91 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 118.895 0.771 . . . . 0.0 112.644 173.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.2 m -129.82 151.12 77.62 Favored Pre-proline 0 N--CA 1.471 0.622 0 C-N-CA 126.603 1.961 . . . . 0.0 112.245 -171.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -72.87 158.76 49.55 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.756 2.971 . . . . 0.0 113.696 -178.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 . . . . . 0 C--O 1.253 1.276 0 C-N-CA 125.787 1.635 . . . . 0.0 112.464 171.013 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.008 0 N-CA-C 111.181 -0.768 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.3 p -67.72 -13.71 62.34 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.588 1.155 . . . . 0.0 113.356 165.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -125.98 165.43 18.8 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.11 1.764 . . . . 0.0 110.479 164.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -144.16 125.74 14.99 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 127.721 2.409 . . . . 0.0 109.936 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 45.6 t -113.07 150.82 31.52 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.645 1.978 . . . . 0.0 114.754 -165.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -137.33 114.26 10.6 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.989 1.316 . . . . 0.0 111.111 168.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 60.8 tp -60.09 -38.32 82.57 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 117.75 -1.119 . . . . 0.0 112.94 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.34 -34.66 78.49 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 120.761 1.619 . . . . 0.0 113.319 179.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 48.2 ttp180 -69.15 -39.35 78.85 Favored 'General case' 0 C--N 1.343 0.293 0 C-N-CA 125.564 1.545 . . . . 0.0 111.593 171.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 24.5 t -70.9 -41.59 71.07 Favored 'General case' 0 C--O 1.22 -0.456 0 C-N-CA 125.21 1.404 . . . . 0.0 110.767 178.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -60.0 -50.65 72.92 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.787 1.235 . . . . 0.0 109.658 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 37.0 tp -62.52 -40.9 98.24 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.064 1.346 . . . . 0.0 112.696 176.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 71.0 m -62.29 -47.09 85.83 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.915 0.886 . . . . 0.0 111.127 174.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.0 m -72.46 -28.26 62.82 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 178.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.65 -37.23 78.15 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.636 -1.29 . . . . 0.0 113.474 177.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 95.1 p -77.03 -2.75 35.6 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.32 1.23 . . . . 0.0 114.32 -178.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -110.25 -1.52 17.26 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.47 1.508 . . . . 0.0 112.32 167.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.48 31.92 12.64 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 125.501 1.525 . . . . 0.0 115.706 175.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -147.25 -169.97 3.44 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-N 119.796 1.798 . . . . 0.0 114.529 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.0 tp -100.09 148.84 24.12 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.465 1.906 . . . . 0.0 111.538 -168.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -93.58 142.91 16.22 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 124.2 0.905 . . . . 0.0 113.784 176.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.0 tptt -132.96 143.35 49.4 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 127.735 2.414 . . . . 0.0 111.442 172.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 26.4 t -105.38 113.48 27.09 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 125.472 1.509 . . . . 0.0 109.795 172.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 60.8 mt -135.83 121.7 30.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 124.472 1.109 . . . . 0.0 108.326 -174.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.58 35.47 62.11 Favored Glycine 0 CA--C 1.535 1.31 0 O-C-N 122.104 -0.372 . . . . 0.0 113.508 -177.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.257 42.9 mt-10 58.45 20.83 7.82 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 126.499 1.92 . . . . 0.0 115.691 -177.515 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -117.41 155.02 30.35 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.899 1.279 . . . . 0.0 111.732 162.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 36.6 t -77.57 135.3 38.16 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.087 0.955 . . . . 0.0 111.357 175.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.9 tptp -140.61 128.81 22.29 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 126.029 1.731 . . . . 0.0 108.802 175.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 16.5 m -86.45 146.4 26.44 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.843 0.83 . . . . 0.0 112.245 179.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.9 m -140.83 161.46 53.98 Favored Pre-proline 0 N--CA 1.473 0.677 0 C-N-CA 127.064 2.145 . . . . 0.0 110.92 -170.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.31 153.85 76.32 Favored 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 122.522 2.148 . . . . 0.0 113.866 174.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 . . . . . 0 C--O 1.258 1.504 0 C-N-CA 125.746 1.618 . . . . 0.0 111.951 162.43 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.109 0 CA-C-O 119.375 -0.68 . . . . 0.0 113.28 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 84.5 p -151.05 3.31 0.45 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 167.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -139.86 173.29 11.68 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.717 1.607 . . . . 0.0 112.268 -177.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -138.07 85.9 2.13 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.743 1.217 . . . . 0.0 112.245 -167.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 51.1 t -73.07 149.48 43.11 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 124.968 1.307 . . . . 0.0 113.414 -177.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -121.36 120.18 34.28 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.761 1.624 . . . . 0.0 111.897 179.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 55.8 tp -65.02 -39.76 93.87 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 117.736 -1.126 . . . . 0.0 112.948 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.64 -41.06 96.4 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 120.598 1.544 . . . . 0.0 112.28 179.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 25.7 ttm180 -67.01 -36.45 82.18 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 126.206 1.803 . . . . 0.0 112.341 175.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 19.8 t -76.15 -38.97 56.06 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 124.776 1.23 . . . . 0.0 111.084 177.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -60.39 -45.17 94.53 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.847 0.859 . . . . 0.0 109.921 173.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -60.49 -47.4 86.29 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.253 1.421 . . . . 0.0 111.433 173.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.5 m -63.42 -36.87 85.18 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.221 1.008 . . . . 0.0 112.787 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 84.1 m -85.41 -35.51 21.26 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 28.2 ttm105 -69.93 -24.26 63.34 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 120.561 -1.337 . . . . 0.0 112.014 175.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 65.6 m -62.44 -15.8 51.49 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 164.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 12.0 mt -101.85 -32.81 10.06 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.903 1.228 . . . . 0.0 111.546 173.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.6 -4.28 4.0 Favored Glycine 0 CA--C 1.536 1.362 0 C-N-CA 125.19 1.376 . . . . 0.0 115.389 174.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -119.49 -163.16 0.96 Allowed 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.144 2.178 . . . . 0.0 112.036 -173.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.4 mp -108.81 163.36 13.34 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.633 1.573 . . . . 0.0 111.499 -175.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -113.35 152.04 18.12 Favored Glycine 0 CA--C 1.536 1.38 0 C-N-CA 125.304 1.43 . . . . 0.0 114.97 -178.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 49.8 mmtt -142.22 152.78 43.43 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 128.752 2.821 . . . . 0.0 111.927 173.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 31.8 m -97.13 108.06 20.71 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.181 1.393 . . . . 0.0 110.421 170.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 49.4 mt -131.76 126.07 56.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 125.986 1.714 . . . . 0.0 109.272 -173.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 63.25 25.35 68.24 Favored Glycine 0 CA--C 1.54 1.626 0 C-N-CA 123.831 0.729 . . . . 0.0 114.288 -174.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 61.55 16.46 7.66 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 127.308 2.243 . . . . 0.0 115.098 -167.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -112.7 160.02 18.34 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.273 1.429 . . . . 0.0 111.753 169.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 40.8 t -72.22 136.57 46.42 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.405 -0.809 . . . . 0.0 111.38 167.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.2 tttt -141.68 141.34 33.34 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 126.666 1.986 . . . . 0.0 110.017 173.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.7 m -100.02 149.95 22.94 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.852 -0.53 . . . . 0.0 112.408 -177.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.4 m -138.29 147.07 54.16 Favored Pre-proline 0 N--CA 1.476 0.851 0 C-N-CA 125.29 1.436 . . . . 0.0 113.272 -179.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -76.1 161.01 36.04 Favored 'Trans proline' 0 CA--C 1.538 0.689 0 C-N-CA 124.632 3.554 . . . . 0.0 112.917 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 18.2 p90 . . . . . 0 C--O 1.25 1.128 0 C-N-CA 125.683 1.593 . . . . 0.0 113.628 179.947 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.231 0 N-CA-C 111.458 -0.657 . . . . 0.0 111.458 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 97.5 p -140.89 24.61 2.18 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 115.76 1.763 . . . . 0.0 115.76 -166.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.44 69.76 0.67 Allowed 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.952 2.101 . . . . 0.0 113.522 -173.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 80.3 t80 61.44 131.78 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 127.822 2.449 . . . . 0.0 114.821 -170.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 46.7 t -91.23 121.91 33.39 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.705 1.202 . . . . 0.0 110.466 173.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 53.6 t-20 -100.38 112.21 24.54 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.895 0.878 . . . . 0.0 109.444 178.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 33.3 tp -61.18 -30.72 70.58 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 117.92 -1.038 . . . . 0.0 112.624 -177.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.87 -51.59 68.65 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 120.127 1.33 . . . . 0.0 112.053 170.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -58.92 -41.64 87.77 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 125.915 1.686 . . . . 0.0 111.909 178.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.2 t -70.8 -48.3 54.93 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.033 1.733 . . . . 0.0 111.701 178.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.65 -44.44 85.67 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.402 1.081 . . . . 0.0 111.79 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -78.81 -29.43 44.81 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.211 1.404 . . . . 0.0 113.26 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.9 m -74.86 -40.02 61.22 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 118.769 0.713 . . . . 0.0 112.228 173.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 84.1 m -66.96 -32.72 74.15 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 118.032 0.378 . . . . 0.0 111.397 169.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -54.0 -38.77 65.45 Favored 'General case' 0 N--CA 1.48 1.026 0 O-C-N 121.016 -1.053 . . . . 0.0 112.897 172.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 73.1 m -72.76 -14.02 61.45 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 115.192 1.553 . . . . 0.0 115.192 -178.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.1 mt -95.75 -13.97 23.73 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.462 0.705 . . . . 0.0 111.441 167.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.97 30.67 5.96 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 126.486 1.993 . . . . 0.0 115.065 177.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -142.73 -163.47 1.63 Allowed 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 119.808 1.804 . . . . 0.0 113.025 176.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.2 mp -108.36 164.64 12.15 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.544 1.938 . . . . 0.0 111.58 -177.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -119.8 154.95 16.28 Favored Glycine 0 CA--C 1.538 1.478 0 C-N-CA 124.835 1.207 . . . . 0.0 115.126 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -135.78 152.82 51.5 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 128.257 2.623 . . . . 0.0 111.249 168.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.7 m -114.89 106.71 14.49 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.156 1.382 . . . . 0.0 112.223 176.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.432 ' CG2' ' H ' ' A' ' 25' ' ' GLY . 28.0 mm -87.61 -168.5 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 127.179 2.192 . . . . 0.0 108.486 174.051 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.432 ' H ' ' CG2' ' A' ' 24' ' ' ILE . . . -57.12 95.68 0.05 OUTLIER Glycine 0 CA--C 1.53 0.972 0 C-N-CA 125.11 1.338 . . . . 0.0 112.768 179.135 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 46.07 30.91 1.02 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 127.6 2.36 . . . . 0.0 114.986 -171.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -140.32 133.8 30.04 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.682 1.193 . . . . 0.0 113.934 -178.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 9.6 t -87.62 124.54 33.64 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 125.814 1.646 . . . . 0.0 110.902 175.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -119.26 147.97 43.67 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.204 1.802 . . . . 0.0 109.281 174.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 19.4 m -106.03 146.48 30.06 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 118.773 0.715 . . . . 0.0 111.533 174.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.6 m -133.51 153.11 80.19 Favored Pre-proline 0 N--CA 1.477 0.914 0 C-N-CA 125.786 1.634 . . . . 0.0 113.916 -169.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -66.87 146.0 76.51 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 124.122 3.214 . . . . 0.0 112.537 173.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 20.2 p90 . . . . . 0 C--O 1.255 1.372 0 C-N-CA 126.622 1.969 . . . . 0.0 112.707 -169.918 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.022 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 62.1 p -154.95 14.88 0.41 Allowed 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.846 1.258 . . . . 0.0 114.374 -178.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.5 10.69 0.76 Allowed 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 116.79 2.145 . . . . 0.0 116.79 176.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 49.75 128.64 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 129.991 3.316 . . . . 0.0 119.084 157.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 7.4 t -71.83 104.48 3.46 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 120.961 -1.087 . . . . 0.0 113.204 -177.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -155.22 116.13 3.92 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.264 1.425 . . . . 0.0 110.534 164.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 59.1 tp -60.38 -41.8 94.53 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 117.625 -1.178 . . . . 0.0 112.402 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.91 -49.73 71.5 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 120.098 1.317 . . . . 0.0 112.164 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.3 ttp-105 -59.94 -40.57 89.37 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 119.329 0.968 . . . . 0.0 112.338 176.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 7.2 t -69.96 -45.91 66.4 Favored 'General case' 0 C--O 1.222 -0.363 0 C-N-CA 125.176 1.39 . . . . 0.0 110.532 -179.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -57.08 -49.11 76.89 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 119.098 0.863 . . . . 0.0 111.591 174.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 87.3 mt -62.4 -41.44 98.66 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.378 1.071 . . . . 0.0 112.452 177.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.9 m -68.13 -42.63 79.91 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.153 0.981 . . . . 0.0 112.2 178.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 61.6 m -72.7 -28.63 62.79 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 178.146 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.38 -43.91 62.01 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.577 1.151 . . . . 0.0 112.453 173.326 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.2 m -69.67 -8.34 46.83 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.36 1.464 . . . . 0.0 114.521 -177.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 mt -115.44 -0.49 13.1 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.203 1.401 . . . . 0.0 111.834 178.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.42 25.47 21.07 Favored Glycine 0 CA--C 1.535 1.296 0 N-CA-C 116.313 1.285 . . . . 0.0 116.313 173.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -148.45 -173.8 4.43 Favored 'General case' 0 CA--C 1.553 1.062 0 CA-C-N 119.197 1.498 . . . . 0.0 114.043 -177.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 89.5 mt -92.85 162.5 14.07 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.948 1.699 . . . . 0.0 111.778 -178.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -123.47 144.96 15.89 Favored Glycine 0 CA--C 1.533 1.214 0 C-N-CA 124.945 1.26 . . . . 0.0 113.935 177.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.93 158.01 43.61 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 125.195 1.398 . . . . 0.0 112.372 170.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 18.5 t -89.62 137.91 31.93 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.281 -0.887 . . . . 0.0 110.843 171.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 56.3 mt -111.51 99.8 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 169.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.06 -73.46 0.18 Allowed Glycine 0 CA--C 1.531 1.079 0 C-N-CA 126.366 1.936 . . . . 0.0 114.289 178.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -138.17 13.95 2.83 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 127.05 2.14 . . . . 0.0 113.587 -173.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -150.52 146.38 26.56 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 120.2 -1.562 . . . . 0.0 112.727 -170.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 10.3 t -78.31 135.78 37.58 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.077 0.951 . . . . 0.0 111.534 174.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -138.56 146.88 42.38 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.469 1.508 . . . . 0.0 110.192 162.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.4 m -88.0 153.96 20.87 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.931 -0.481 . . . . 0.0 111.524 176.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.6 m -138.13 151.78 70.52 Favored Pre-proline 0 N--CA 1.473 0.713 0 C-N-CA 126.677 1.991 . . . . 0.0 111.561 -171.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -74.36 164.98 32.86 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 124.072 3.181 . . . . 0.0 113.695 -169.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 . . . . . 0 C--O 1.258 1.524 0 C-N-CA 125.12 1.368 . . . . 0.0 113.043 169.556 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.928 0 N-CA-C 110.765 -0.934 . . . . 0.0 110.765 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.1 m -69.19 132.76 47.04 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.531 1.132 . . . . 0.0 112.347 -173.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -129.1 14.04 6.22 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.47 1.656 . . . . 0.0 115.47 -166.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 61.25 148.1 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 127.378 2.271 . . . . 0.0 115.342 -174.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.7 t -94.89 156.34 16.39 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.868 1.667 . . . . 0.0 111.568 172.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -131.86 124.19 29.06 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.264 1.426 . . . . 0.0 108.673 167.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 29.6 tp -61.46 -41.15 96.79 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 118.3 -0.857 . . . . 0.0 112.139 -173.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.41 -37.41 87.18 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-N 119.798 1.181 . . . . 0.0 113.903 176.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 54.3 ttp180 -70.28 -39.61 74.8 Favored 'General case' 0 C--N 1.343 0.305 0 C-N-CA 125.304 1.441 . . . . 0.0 112.284 175.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 45.0 t -72.44 -38.55 68.29 Favored 'General case' 0 C--O 1.223 -0.341 0 C-N-CA 125.78 1.632 . . . . 0.0 111.151 179.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -56.33 -52.29 65.1 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 124.703 1.201 . . . . 0.0 110.595 175.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 44.8 mt -69.57 -37.57 77.05 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.604 0.762 . . . . 0.0 112.944 176.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 68.6 m -58.06 -41.05 82.52 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 121.817 -0.552 . . . . 0.0 111.694 171.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 83.6 m -75.76 -31.96 59.76 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 173.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.12 -35.59 73.72 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 120.63 -1.294 . . . . 0.0 112.261 172.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.2 t -60.5 -15.77 30.41 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.716 1.607 . . . . 0.0 113.991 173.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.8 mt -110.23 -6.9 14.93 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.297 1.439 . . . . 0.0 112.497 173.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.22 23.36 10.53 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 125.623 1.583 . . . . 0.0 116.604 174.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -144.82 -173.12 3.98 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 119.091 1.446 . . . . 0.0 113.749 -177.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 91.1 mt -92.77 159.3 15.47 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.444 1.498 . . . . 0.0 111.575 -176.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -116.06 148.63 18.89 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 124.199 0.904 . . . . 0.0 114.684 -178.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -135.83 150.1 49.29 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 127.918 2.487 . . . . 0.0 111.79 172.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 50.6 m -97.15 107.22 19.7 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 123.526 0.731 . . . . 0.0 109.324 168.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 45.6 mm -81.85 -177.26 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 164.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -53.52 101.73 0.09 OUTLIER Glycine 0 CA--C 1.534 1.274 0 O-C-N 120.513 -1.367 . . . . 0.0 112.956 -177.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 61.14 7.67 1.69 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 127.97 2.508 . . . . 0.0 116.185 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -137.15 147.89 46.26 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.883 1.673 . . . . 0.0 113.253 -175.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 43.0 t -76.85 141.85 40.47 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.058 1.343 . . . . 0.0 111.699 171.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.6 tppt? -144.9 148.89 34.41 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 127.964 2.506 . . . . 0.0 108.732 175.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 10.5 m -104.41 156.39 17.97 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.3 m -140.18 151.56 64.99 Favored Pre-proline 0 N--CA 1.472 0.654 0 C-N-CA 126.488 1.915 . . . . 0.0 111.485 -176.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.49 160.13 50.95 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 124.122 3.215 . . . . 0.0 113.315 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 . . . . . 0 C--O 1.255 1.38 0 C-N-CA 126.098 1.759 . . . . 0.0 113.767 172.51 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.02 0 N-CA-C 111.231 -0.747 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.3 p -158.02 -27.22 0.08 Allowed 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 115.836 1.791 . . . . 0.0 115.836 -165.053 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -144.86 -11.95 0.57 Allowed 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 117.126 2.269 . . . . 0.0 117.126 -169.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 60.1 t80 55.49 120.32 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 128.246 2.618 . . . . 0.0 115.209 -174.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 33.8 t -74.58 124.25 26.32 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.402 1.081 . . . . 0.0 113.133 -173.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -104.57 118.77 37.4 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 161.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.4 tp -57.87 -36.89 72.99 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 118.044 -0.979 . . . . 0.0 113.051 -175.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.0 -45.3 93.06 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 120.047 1.294 . . . . 0.0 112.646 173.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 21.7 ttm180 -65.78 -37.46 86.37 Favored 'General case' 0 C--N 1.346 0.414 0 C-N-CA 125.601 1.561 . . . . 0.0 113.054 175.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.6 t -72.44 -43.89 63.16 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 125.669 1.588 . . . . 0.0 110.064 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -59.82 -43.12 94.71 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.836 -0.54 . . . . 0.0 110.81 172.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 63.1 mt -64.72 -40.38 95.24 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.066 0.848 . . . . 0.0 113.157 173.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.4 m -68.59 -39.23 81.02 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.002 0.921 . . . . 0.0 111.1 -179.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.4 m -73.93 -30.08 62.37 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 171.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -62.63 -33.22 74.57 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.196 -1.565 . . . . 0.0 111.908 170.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 44.2 m -66.47 -11.87 54.44 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 170.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.1 mt -102.72 -19.49 14.73 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 120.458 1.481 . . . . 0.0 112.318 166.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 103.6 30.77 5.13 Favored Glycine 0 CA--C 1.538 1.474 0 C-N-CA 125.789 1.661 . . . . 0.0 115.376 177.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -150.36 -177.59 6.03 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.774 1.23 . . . . 0.0 113.409 178.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.7 tp -83.34 145.82 28.84 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.629 1.572 . . . . 0.0 111.577 -174.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -105.53 144.97 15.86 Favored Glycine 0 N--CA 1.472 1.081 0 C-N-CA 123.735 0.684 . . . . 0.0 113.452 175.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -137.76 151.54 48.27 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.203 1.801 . . . . 0.0 112.401 175.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 75.1 m -96.43 118.66 33.42 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 124.67 1.188 . . . . 0.0 109.787 170.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.6 mp -104.48 104.6 17.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 125.538 1.535 . . . . 0.0 107.116 178.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.65 -77.1 0.06 OUTLIER Glycine 0 CA--C 1.53 1.008 0 C-N-CA 125.29 1.424 . . . . 0.0 112.83 -167.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -142.64 0.8 1.29 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.724 1.609 . . . . 0.0 114.495 -177.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -128.03 150.26 50.01 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 119.593 1.088 . . . . 0.0 113.065 -177.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 45.0 t -77.85 134.58 37.93 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.761 1.624 . . . . 0.0 112.964 -175.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -141.62 165.88 26.28 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 127.982 2.513 . . . . 0.0 109.709 165.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.9 m -114.52 153.94 29.12 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 114.442 1.275 . . . . 0.0 114.442 -175.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.3 m -145.92 164.71 23.94 Favored Pre-proline 0 N--CA 1.485 1.309 0 C-N-CA 127.646 2.379 . . . . 0.0 111.665 -177.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -66.78 153.25 78.6 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.741 2.294 . . . . 0.0 113.077 172.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 . . . . . 0 C--O 1.25 1.084 0 C-N-CA 126.537 1.935 . . . . 0.0 113.255 177.443 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.949 0 N-CA-C 112.266 -0.334 . . . . 0.0 112.266 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.5 t -148.43 176.83 9.97 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.838 0.855 . . . . 0.0 112.418 179.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 51.43 39.47 24.49 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 127.971 2.508 . . . . 0.0 115.424 176.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -139.59 32.38 2.05 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.634 1.174 . . . . 0.0 113.347 -177.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -87.9 -140.9 0.11 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 127.465 2.306 . . . . 0.0 113.579 -176.409 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 61.74 120.38 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 130.461 3.504 . . . . 0.0 113.949 -171.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 61.7 tp -49.38 -41.85 40.41 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.597 1.159 . . . . 0.0 111.904 172.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.31 -33.62 76.41 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 -176.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 60.1 ttt180 -78.62 -43.08 27.16 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 126.546 1.938 . . . . 0.0 111.125 175.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 25.1 t -71.07 -41.05 71.2 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 127.353 2.261 . . . . 0.0 112.087 -173.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -53.95 -45.28 71.24 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 119.239 0.927 . . . . 0.0 112.773 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.01 -35.24 61.99 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.781 1.232 . . . . 0.0 111.937 -178.079 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 69.2 m -71.72 -35.82 70.3 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.446 0.698 . . . . 0.0 112.755 173.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 81.1 m -71.52 -27.75 63.41 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 119.485 1.038 . . . . 0.0 113.145 172.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.36 -38.72 66.39 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.323 1.049 . . . . 0.0 113.755 -176.022 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 88.5 p -69.04 -11.85 61.16 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 -175.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.1 mt -108.23 1.74 22.27 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.203 1.401 . . . . 0.0 112.1 174.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.14 17.83 35.98 Favored Glycine 0 CA--C 1.535 1.283 0 C-N-CA 126.08 1.8 . . . . 0.0 116.372 170.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -136.76 -175.05 3.89 Favored 'General case' 0 CA--C 1.551 0.987 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 -171.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 70.1 mt -92.83 156.73 16.79 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 126.505 1.922 . . . . 0.0 111.148 -176.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -112.93 150.61 18.41 Favored Glycine 0 N--CA 1.472 1.058 0 C-N-CA 124.247 0.927 . . . . 0.0 114.311 176.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -142.76 154.54 44.35 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 127.956 2.502 . . . . 0.0 111.978 170.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -118.83 120.7 38.1 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.144 1.778 . . . . 0.0 111.452 -177.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.5 mp -141.93 128.33 19.2 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 125.627 1.571 . . . . 0.0 109.722 -177.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.94 44.07 94.64 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 124.396 0.998 . . . . 0.0 114.499 170.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.264 4.2 mm-40 62.42 20.54 11.95 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 126.535 1.934 . . . . 0.0 115.273 -175.359 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -131.75 142.9 49.9 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.603 -1.31 . . . . 0.0 113.055 173.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 10.2 t -76.84 134.39 39.06 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.805 1.242 . . . . 0.0 111.141 165.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.1 ttpt -138.83 138.4 37.48 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.641 1.176 . . . . 0.0 110.45 167.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.0 m -96.39 144.49 26.48 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.675 0.79 . . . . 0.0 112.083 -172.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.0 m -128.32 151.95 77.25 Favored Pre-proline 0 N--CA 1.473 0.683 0 C-N-CA 126.576 1.95 . . . . 0.0 112.093 -170.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.79 151.32 57.2 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.02 2.48 . . . . 0.0 112.625 -176.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 . . . . . 0 C--O 1.251 1.156 0 C-N-CA 124.119 0.967 . . . . 0.0 110.417 165.398 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.15 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.0 p -67.86 -30.27 69.6 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 122.02 -0.694 . . . . 0.0 111.671 170.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -122.49 -167.0 1.5 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.738 2.015 . . . . 0.0 109.387 161.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 22.0 p90 -139.31 158.91 43.34 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 127.063 2.145 . . . . 0.0 108.988 177.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.4 t -70.56 107.18 3.76 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 122.87 1.319 . . . . 0.0 111.715 172.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -136.93 113.72 10.37 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 105.876 -1.898 . . . . 0.0 105.876 145.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 51.6 tp -57.53 -37.17 72.6 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.399 -0.81 . . . . 0.0 111.814 -176.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.61 -47.84 58.1 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.503 1.047 . . . . 0.0 112.663 -179.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.84 -43.31 76.9 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.195 1.398 . . . . 0.0 111.669 176.029 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.7 t -72.81 -50.94 21.03 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 126.959 2.103 . . . . 0.0 110.693 -178.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -53.32 -49.63 66.65 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.944 0.898 . . . . 0.0 111.457 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 87.4 mt -74.46 -34.31 63.12 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.476 1.11 . . . . 0.0 113.27 -175.101 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 37.7 m -66.82 -45.96 76.64 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.002 0.521 . . . . 0.0 110.659 170.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 73.0 m -58.96 -36.61 75.11 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 122.816 0.446 . . . . 0.0 111.599 171.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -34.43 71.85 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 120.623 -1.298 . . . . 0.0 113.422 175.663 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.8 p -66.11 -15.03 62.74 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 174.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.5 mt -102.59 -9.49 20.09 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.509 1.123 . . . . 0.0 112.023 170.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 120.42 -9.81 10.82 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 126.782 2.134 . . . . 0.0 116.354 172.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -125.59 -173.14 2.76 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 115.76 1.763 . . . . 0.0 115.76 -159.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 79.3 mt -94.01 161.69 14.19 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.222 1.409 . . . . 0.0 111.856 -175.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -118.12 137.6 13.2 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 125.343 1.449 . . . . 0.0 113.116 173.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.7 mptt -134.07 134.86 42.82 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 127.21 2.204 . . . . 0.0 110.66 174.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 29.1 m -75.08 151.68 38.63 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 121.745 0.783 . . . . 0.0 112.261 175.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 30.3 mt -123.83 75.63 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 126.445 1.898 . . . . 0.0 107.556 174.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.15 -96.61 0.14 Allowed Glycine 0 CA--C 1.531 1.07 0 CA-C-N 114.337 -1.301 . . . . 0.0 112.193 -170.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -98.5 -0.22 43.79 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.374 1.47 . . . . 0.0 114.578 -179.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -111.76 168.13 9.81 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 127.687 2.395 . . . . 0.0 111.071 177.718 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 9.2 t -146.13 138.11 25.08 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 120.704 -1.247 . . . . 0.0 114.231 167.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 33.7 mmtm -139.06 163.07 33.37 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 126.235 1.814 . . . . 0.0 110.861 -174.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 7.5 m -89.09 156.74 18.64 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -177.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.4 m -148.58 152.23 37.64 Favored Pre-proline 0 N--CA 1.466 0.359 0 C-N-CA 126.218 1.807 . . . . 0.0 111.92 -176.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -73.07 165.69 32.06 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.39 2.727 . . . . 0.0 112.273 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 . . . . . 0 C--O 1.249 1.068 0 C-N-CA 126.217 1.807 . . . . 0.0 112.272 -178.931 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.579 0 N-CA-C 110.027 -1.229 . . . . 0.0 110.027 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.4 p -129.01 -20.22 3.48 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.205 1.402 . . . . 0.0 113.638 178.18 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -123.16 -0.42 8.88 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 115.998 1.851 . . . . 0.0 115.998 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 40.93 68.04 0.46 Allowed 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 127.372 2.269 . . . . 0.0 113.102 168.031 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.1 t -65.21 119.14 10.33 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -154.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -107.33 122.58 46.87 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.24 149.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 65.4 tp -64.15 -37.64 88.2 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 117.891 -1.052 . . . . 0.0 112.999 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.39 -46.12 90.06 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 120.208 1.367 . . . . 0.0 111.542 178.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -65.85 -39.7 91.0 Favored 'General case' 0 C--N 1.346 0.441 0 C-N-CA 125.076 1.351 . . . . 0.0 112.841 173.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 19.7 t -63.13 -48.26 79.27 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 124.988 1.315 . . . . 0.0 110.124 178.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -59.88 -47.52 85.42 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.778 0.831 . . . . 0.0 111.104 175.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 51.4 mt -61.1 -44.48 97.29 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.968 0.804 . . . . 0.0 112.555 177.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 58.7 m -72.51 -41.03 66.38 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.163 0.985 . . . . 0.0 112.367 -178.224 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 77.0 m -64.33 -39.13 93.29 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.109 0.868 . . . . 0.0 110.992 172.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.1 ttm105 -67.02 -28.73 68.47 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.074 -1.016 . . . . 0.0 113.106 178.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 61.8 m -64.3 -11.14 28.93 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.614 1.339 . . . . 0.0 114.614 168.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.13 2.17 16.61 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 125.251 1.42 . . . . 0.0 112.18 170.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 90.94 18.37 47.51 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 126.074 1.797 . . . . 0.0 116.161 173.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -136.56 178.24 7.22 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 119.119 1.459 . . . . 0.0 114.344 -176.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -94.0 134.06 36.81 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.38 1.872 . . . . 0.0 111.718 -162.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -91.83 132.05 11.08 Favored Glycine 0 CA--C 1.532 1.114 0 CA-C-N 118.491 0.587 . . . . 0.0 113.821 179.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.5 tppt? -123.9 139.14 54.26 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 126.59 1.956 . . . . 0.0 111.56 176.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 7.1 t -105.6 125.63 51.21 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.989 0.915 . . . . 0.0 110.367 175.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.0 mt -118.51 82.79 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 125.302 1.441 . . . . 0.0 108.258 -177.016 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.57 -93.82 0.03 OUTLIER Glycine 0 CA--C 1.532 1.152 0 C-N-CA 125.229 1.395 . . . . 0.0 111.798 -167.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -96.49 -10.49 27.29 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.165 1.786 . . . . 0.0 114.819 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -105.0 147.6 27.62 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 120.52 1.509 . . . . 0.0 114.463 -175.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.4 t -106.52 121.33 44.08 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 124.817 1.247 . . . . 0.0 110.22 171.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -125.87 147.84 49.35 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 126.01 1.724 . . . . 0.0 109.971 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 6.9 m -107.49 143.69 35.5 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 122.792 0.437 . . . . 0.0 111.915 173.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.6 m -135.21 149.05 68.91 Favored Pre-proline 0 N--CA 1.474 0.769 0 C-N-CA 125.18 1.392 . . . . 0.0 112.603 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -82.84 58.74 6.51 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 124.468 3.446 . . . . 0.0 112.656 -170.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 . . . . . 0 C--O 1.252 1.199 0 C-N-CA 127.642 2.377 . . . . 0.0 114.171 -179.44 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.884 0 N-CA-C 110.837 -0.905 . . . . 0.0 110.837 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.5 m -80.25 0.84 30.92 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.545 1.538 . . . . 0.0 114.722 -169.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -134.7 11.73 3.71 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 114.071 1.138 . . . . 0.0 114.071 174.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -44.29 107.0 0.08 Allowed 'General case' 0 C--O 1.234 0.273 0 C-N-CA 129.237 3.015 . . . . 0.0 112.754 -176.066 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 50.8 t -62.92 124.22 20.52 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 113.878 -1.51 . . . . 0.0 114.752 -157.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -121.46 107.63 12.68 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.153 1.381 . . . . 0.0 107.583 153.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 41.8 tp -63.65 -33.21 75.11 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 118.232 -0.889 . . . . 0.0 112.657 -175.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.27 -44.66 78.77 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 119.52 1.055 . . . . 0.0 112.795 177.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -77.49 -29.91 52.79 Favored 'General case' 0 C--N 1.344 0.353 0 C-N-CA 124.148 0.979 . . . . 0.0 113.447 178.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.8 t -68.07 -44.26 76.73 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 124.965 1.306 . . . . 0.0 110.121 170.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -57.54 -47.35 82.24 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.879 0.763 . . . . 0.0 110.931 171.19 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.6 tt -57.32 -46.14 83.51 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.832 0.853 . . . . 0.0 111.239 176.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 48.8 m -70.35 -47.63 60.11 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.519 1.127 . . . . 0.0 112.82 -178.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 70.7 m -63.4 -42.88 98.8 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 118.639 0.654 . . . . 0.0 111.179 175.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.5 ttm-85 -74.2 -22.07 59.54 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.745 -1.222 . . . . 0.0 112.651 -177.078 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.8 m -72.19 -16.69 61.97 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 167.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.1 mt -89.53 -30.17 18.41 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.271 0.941 . . . . 0.0 111.333 163.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 128.28 12.88 2.73 Favored Glycine 0 CA--C 1.536 1.372 0 C-N-CA 125.672 1.606 . . . . 0.0 115.744 173.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -135.4 173.57 11.57 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 119.609 1.704 . . . . 0.0 114.595 -172.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.8 tp -84.87 135.85 33.9 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.379 1.471 . . . . 0.0 111.544 -167.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.58 137.99 15.86 Favored Glycine 0 CA--C 1.538 1.494 0 CA-C-N 118.725 0.693 . . . . 0.0 113.299 170.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.11 128.21 22.3 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.014 1.726 . . . . 0.0 113.878 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 6.7 t -91.63 133.42 35.58 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.265 1.426 . . . . 0.0 111.587 -179.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 13.1 mt -138.98 112.97 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.751 1.221 . . . . 0.0 110.396 -175.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.11 -100.76 0.43 Allowed Glycine 0 CA--C 1.53 1.017 0 N-CA-C 110.558 -1.017 . . . . 0.0 110.558 -168.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -126.99 7.95 6.69 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 126.671 1.988 . . . . 0.0 113.965 176.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -123.61 150.14 44.49 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.707 1.203 . . . . 0.0 110.258 -178.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.1 t -105.44 145.98 30.12 Favored 'General case' 0 CA--C 1.537 0.481 0 O-C-N 121.372 -0.83 . . . . 0.0 112.581 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -122.16 163.42 19.56 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 128.193 2.597 . . . . 0.0 109.839 174.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.9 m -106.34 149.18 27.21 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 122.056 -0.403 . . . . 0.0 111.598 163.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.2 m -142.4 156.09 64.03 Favored Pre-proline 0 N--CA 1.479 0.995 0 C-N-CA 124.999 1.32 . . . . 0.0 113.714 -172.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -84.5 51.55 3.3 Favored 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 124.987 3.791 . . . . 0.0 113.056 -172.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 . . . . . 0 C--O 1.252 1.229 0 C-N-CA 126.577 1.951 . . . . 0.0 113.604 -178.062 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.769 0 N-CA-C 110.348 -1.101 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.5 m 54.41 32.75 17.16 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.788 1.635 . . . . 0.0 115.253 -179.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.75 59.16 2.47 Favored 'General case' 0 CA--C 1.553 1.077 0 O-C-N 120.841 -1.162 . . . . 0.0 113.021 177.606 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 1.2 t80 47.08 86.21 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 128.456 2.703 . . . . 0.0 116.484 167.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 9.4 t -63.87 129.43 40.06 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.15 1.38 . . . . 0.0 111.913 165.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -175.67 116.95 0.15 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 127.437 2.295 . . . . 0.0 106.697 167.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 29.7 tp -59.22 -40.86 87.18 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.754 1.161 . . . . 0.0 112.438 -173.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.7 -48.49 81.54 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 119.488 1.04 . . . . 0.0 112.433 178.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -60.07 -43.42 95.47 Favored 'General case' 0 C--N 1.346 0.432 0 C-N-CA 125.645 1.578 . . . . 0.0 112.832 172.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 7.9 t -77.38 -43.38 32.96 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 124.986 1.314 . . . . 0.0 111.44 -169.58 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -58.72 -44.49 90.43 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.823 1.192 . . . . 0.0 111.162 171.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 79.1 mt -64.55 -38.5 91.22 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 175.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 63.0 m -79.1 -32.38 44.6 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.763 1.225 . . . . 0.0 113.116 -179.24 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 58.6 m -73.33 -27.29 61.44 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 119.009 -0.519 . . . . 0.0 111.129 169.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -35.79 75.33 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 119.836 1.198 . . . . 0.0 112.944 167.658 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.7 m -63.51 -19.94 65.19 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.222 1.009 . . . . 0.0 113.083 174.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 21.0 mt -100.2 -27.24 13.62 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.28 1.432 . . . . 0.0 112.349 172.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 105.33 17.97 12.83 Favored Glycine 0 CA--C 1.539 1.59 0 C-N-CA 126.199 1.857 . . . . 0.0 115.911 178.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -134.56 -177.56 4.66 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.382 1.591 . . . . 0.0 113.13 -175.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 30.3 tp -91.27 140.83 29.42 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.121 1.768 . . . . 0.0 112.706 -165.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -92.14 141.71 15.72 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 124.817 1.199 . . . . 0.0 115.938 -178.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.3 tppt? -143.53 173.62 11.48 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 128.054 2.542 . . . . 0.0 112.927 176.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 35.8 t -126.2 144.73 50.66 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.526 1.53 . . . . 0.0 110.864 174.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 55.6 mt -135.54 118.16 22.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 124.288 1.035 . . . . 0.0 108.348 166.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.23 -79.92 0.63 Allowed Glycine 0 N--CA 1.472 1.055 0 C-N-CA 124.327 0.965 . . . . 0.0 114.412 171.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -150.83 18.42 0.79 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 127.833 2.453 . . . . 0.0 112.003 176.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -120.45 145.37 47.31 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.429 2.292 . . . . 0.0 112.663 -177.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 2.1 t -83.88 132.36 34.8 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 124.946 1.298 . . . . 0.0 110.06 169.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -136.31 131.4 34.3 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.75 1.22 . . . . 0.0 110.319 -177.594 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 6.3 m -99.19 144.27 28.51 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.182 0.593 . . . . 0.0 111.796 177.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.0 m -134.65 155.19 79.72 Favored Pre-proline 0 N--CA 1.474 0.756 0 C-N-CA 125.921 1.689 . . . . 0.0 112.702 -177.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -71.38 161.99 43.81 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.719 2.946 . . . . 0.0 112.659 174.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 83.7 m-85 . . . . . 0 C--O 1.251 1.143 0 C-N-CA 125.421 1.488 . . . . 0.0 114.065 -176.238 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.166 0 N-CA-C 111.191 -0.764 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.6 p -62.02 -26.21 68.1 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 126.928 2.091 . . . . 0.0 115.594 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -121.26 -16.82 7.84 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -170.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 18.4 t80 67.26 130.1 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 128.531 2.732 . . . . 0.0 117.071 167.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.5 t -78.4 93.94 4.8 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 120.633 -1.292 . . . . 0.0 112.977 176.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 55.2 t-20 -151.57 111.94 4.15 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.049 1.34 . . . . 0.0 109.544 161.245 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 42.3 tp -52.26 -41.12 62.55 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.071 0.948 . . . . 0.0 112.647 177.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.25 90.27 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 118.939 0.79 . . . . 0.0 112.91 -177.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 59.7 ttt180 -71.42 -43.21 67.18 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.701 1.6 . . . . 0.0 111.401 174.277 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 19.7 t -68.46 -40.06 81.19 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 126.442 1.897 . . . . 0.0 112.007 -176.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -60.05 -44.11 94.9 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.802 0.728 . . . . 0.0 112.299 178.379 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -74.16 -33.98 63.68 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.75 0.82 . . . . 0.0 112.448 177.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 28.4 m -65.49 -47.28 76.59 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 121.601 -0.687 . . . . 0.0 111.87 172.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.2 m -70.81 -34.54 71.84 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 118.735 0.698 . . . . 0.0 112.594 177.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 41.9 ttm180 -54.91 -34.35 63.04 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 121.289 -0.882 . . . . 0.0 111.161 168.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.3 m -77.54 0.58 22.4 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 176.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.2 mt -115.92 -3.83 12.12 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 125.278 1.431 . . . . 0.0 112.075 165.119 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.43 19.02 31.23 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 125.733 1.635 . . . . 0.0 116.383 175.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -143.78 -172.05 3.66 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.367 1.467 . . . . 0.0 112.89 -179.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 20.5 tp -94.25 150.77 19.99 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.461 1.504 . . . . 0.0 111.901 -168.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -106.04 142.81 15.65 Favored Glycine 0 CA--C 1.532 1.113 0 O-C-N 121.424 -0.797 . . . . 0.0 114.523 177.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -142.64 160.94 39.32 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 128.031 2.532 . . . . 0.0 111.036 169.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 4.7 t -97.44 138.09 35.42 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.762 -0.586 . . . . 0.0 111.387 167.006 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 55.1 mt -126.49 116.04 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 125.358 1.463 . . . . 0.0 108.848 168.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.41 -96.65 0.15 Allowed Glycine 0 CA--C 1.532 1.127 0 C-N-CA 125.064 1.316 . . . . 0.0 112.453 -176.101 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -125.33 18.89 8.23 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 125.956 1.702 . . . . 0.0 113.62 178.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -129.61 145.27 51.5 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.295 1.438 . . . . 0.0 112.861 -174.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 9.6 t -74.95 128.11 34.79 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.231 0.613 . . . . 0.0 109.84 160.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -130.45 132.7 45.83 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.306 1.442 . . . . 0.0 108.776 174.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 22.5 m -92.84 139.7 30.27 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 120.787 0.327 . . . . 0.0 111.687 -177.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.7 m -127.34 152.69 76.61 Favored Pre-proline 0 N--CA 1.469 0.517 0 C-N-CA 126.011 1.725 . . . . 0.0 110.984 -168.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -63.24 158.93 41.83 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.287 2.658 . . . . 0.0 112.365 -177.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 . . . . . 0 C--O 1.253 1.262 0 C-N-CA 124.576 1.151 . . . . 0.0 109.765 159.591 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 . . . . . 0 CA--C 1.536 0.429 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 53.9 tp -58.26 -45.25 88.16 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-O 117.909 -1.043 . . . . 0.0 112.316 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.2 -39.81 79.92 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 120.208 1.367 . . . . 0.0 112.957 175.733 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 32.5 ttp180 -78.16 -33.94 49.97 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.291 1.437 . . . . 0.0 113.379 -179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 35.6 t -69.19 -40.82 77.82 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 126.062 1.745 . . . . 0.0 109.933 171.683 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -61.64 -44.72 96.45 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.291 1.037 . . . . 0.0 111.639 175.149 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 26.8 mt -66.77 -28.72 68.62 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.177 1.391 . . . . 0.0 113.62 173.584 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 63.1 m -77.93 -47.78 17.83 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.729 1.212 . . . . 0.0 112.085 175.216 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 68.4 m -67.49 -31.6 71.85 Favored 'General case' 0 CA--C 1.549 0.91 0 O-C-N 121.248 -0.908 . . . . 0.0 111.774 178.131 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 42.4 ttm-85 -53.64 -32.95 53.5 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.529 1.532 . . . . 0.0 112.964 166.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.0 m -71.46 -16.74 62.38 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 114.301 1.222 . . . . 0.0 114.301 177.238 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.1 mt -108.27 -11.06 15.28 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.401 1.08 . . . . 0.0 112.459 175.706 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 98.42 27.19 8.77 Favored Glycine 0 CA--C 1.537 1.407 0 C-N-CA 125.621 1.581 . . . . 0.0 115.635 174.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -145.28 178.64 7.94 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 119.232 1.516 . . . . 0.0 112.725 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.3 tp -86.78 148.57 25.35 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.913 1.285 . . . . 0.0 111.639 -170.606 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -100.09 143.24 16.28 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 123.915 0.769 . . . . 0.0 114.099 173.738 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.13 157.4 44.93 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 127.344 2.258 . . . . 0.0 110.474 169.281 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 85.7 m -100.19 133.71 44.18 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.417 -0.802 . . . . 0.0 110.533 171.136 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 71.6 mt -138.5 125.14 25.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.181 1.393 . . . . 0.0 108.617 177.695 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.63 33.2 76.21 Favored Glycine 0 CA--C 1.539 1.552 0 O-C-N 121.487 -0.758 . . . . 0.0 114.265 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 60.72 21.11 11.13 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 127.043 2.137 . . . . 0.0 114.907 -172.146 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -120.72 152.5 38.19 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.156 1.783 . . . . 0.0 110.953 173.103 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 33.2 t -76.75 131.02 38.5 Favored 'General case' 0 C--O 1.241 0.657 0 O-C-N 121.593 -0.692 . . . . 0.0 110.525 176.228 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 42.9 tttt -139.35 127.61 22.67 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.729 1.212 . . . . 0.0 109.974 175.541 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 12.5 m -89.79 151.79 21.62 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.606 -177.429 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.4 m -141.05 150.55 59.47 Favored Pre-proline 0 N--CA 1.474 0.737 0 C-N-CA 124.883 1.273 . . . . 0.0 113.112 -175.54 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -79.19 65.89 8.82 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 124.66 3.574 . . . . 0.0 112.845 -175.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 . . . . . 0 C--O 1.253 1.261 0 C-N-CA 128.404 2.682 . . . . 0.0 114.159 -179.932 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.496 ' N ' ' HG ' ' A' ' 23' ' ' CYS . 8.8 t-20 . . . . . 0 CA--C 1.532 0.253 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 44.4 tp -53.91 -40.53 66.76 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 119.275 0.943 . . . . 0.0 112.001 167.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.29 -42.07 84.35 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.703 1.138 . . . . 0.0 112.981 177.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 31.8 mtp180 -69.13 -36.25 77.27 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.658 1.183 . . . . 0.0 112.386 177.367 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 16.0 t -78.0 -36.38 48.87 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 125.694 1.598 . . . . 0.0 110.854 178.122 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -55.09 -47.61 74.7 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.58 0.752 . . . . 0.0 111.258 167.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 53.5 mt -63.14 -50.73 69.27 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.222 0.609 . . . . 0.0 111.884 174.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 44.4 m -64.02 -43.51 95.37 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -176.565 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 78.6 m -65.44 -35.17 80.12 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.189 0.904 . . . . 0.0 112.631 173.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 26.4 ttm105 -69.77 -19.59 63.51 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 120.994 -1.066 . . . . 0.0 113.046 178.18 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.2 p -62.92 -31.1 72.1 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 118.569 0.622 . . . . 0.0 112.511 166.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 mt -91.31 -6.04 53.73 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.531 1.132 . . . . 0.0 112.555 173.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.24 12.46 39.07 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 126.623 2.059 . . . . 0.0 115.916 174.368 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -134.79 -177.71 4.75 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 120.08 1.94 . . . . 0.0 113.473 -175.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 80.6 mt -94.14 164.03 13.22 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.6 1.16 . . . . 0.0 111.894 -169.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -117.3 146.54 18.78 Favored Glycine 0 N--CA 1.474 1.225 0 N-CA-C 116.119 1.208 . . . . 0.0 116.119 -171.191 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 57.4 mmtt -133.9 134.38 42.6 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 127.348 2.259 . . . . 0.0 111.664 165.565 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.496 ' HG ' ' N ' ' A' ' 6' ' ' ASN . 53.6 t -114.0 109.53 18.61 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.916 1.286 . . . . 0.0 109.925 -177.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 36.9 mm -140.14 127.06 23.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 124.475 1.11 . . . . 0.0 109.723 -167.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.29 29.72 75.8 Favored Glycine 0 CA--C 1.536 1.371 0 CA-C-O 119.379 -0.678 . . . . 0.0 114.609 177.321 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 62.46 29.32 17.11 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.933 1.693 . . . . 0.0 114.484 -175.133 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -135.41 155.03 51.22 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.569 1.948 . . . . 0.0 109.917 168.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 10.0 t -107.77 135.38 49.29 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.32 1.048 . . . . 0.0 112.321 -175.279 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 66.1 mmtt -136.83 153.62 50.74 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 127.156 2.182 . . . . 0.0 111.307 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 12.3 m -115.95 149.35 38.89 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 -174.17 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.3 m -138.6 156.97 72.9 Favored Pre-proline 0 N--CA 1.481 1.087 0 C-N-CA 127.051 2.14 . . . . 0.0 113.07 -170.338 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -83.44 165.37 14.34 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 124.069 3.179 . . . . 0.0 114.684 -173.416 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 . . . . . 0 C--O 1.256 1.402 0 C-N-CA 125.53 1.532 . . . . 0.0 112.012 167.595 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 45.3 t30 . . . . . 0 CA--C 1.534 0.348 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 46.7 tp -57.67 -34.44 69.39 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 118.719 -0.658 . . . . 0.0 112.137 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.23 -46.63 87.96 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 118.975 0.807 . . . . 0.0 112.686 176.225 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 18.7 ttt180 -66.12 -45.02 82.59 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 126.038 1.735 . . . . 0.0 111.994 175.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 49.7 t -65.55 -44.66 86.15 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 125.402 1.481 . . . . 0.0 111.222 -176.487 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -54.64 -52.02 63.6 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.562 0.745 . . . . 0.0 111.16 176.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 16.6 tp -73.76 -28.25 61.58 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.662 1.185 . . . . 0.0 113.299 -176.033 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.4 m -73.4 -47.53 41.19 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.678 0.791 . . . . 0.0 110.867 173.287 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 95.7 m -60.89 -31.55 71.04 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 171.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -52.82 -32.2 42.96 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.355 1.062 . . . . 0.0 113.649 173.752 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 54.6 p -63.58 -24.27 67.73 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.3 mt -97.71 -8.75 27.99 Favored 'General case' 0 N--CA 1.477 0.903 0 O-C-N 121.047 -1.033 . . . . 0.0 112.22 174.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 111.47 6.6 25.2 Favored Glycine 0 CA--C 1.532 1.156 0 C-N-CA 126.716 2.103 . . . . 0.0 115.586 172.417 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -130.01 -172.04 2.68 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 119.972 1.886 . . . . 0.0 114.953 -167.089 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.2 mt -92.9 157.69 16.23 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.306 1.442 . . . . 0.0 111.203 -176.008 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -110.39 147.96 17.49 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 124.911 1.243 . . . . 0.0 113.941 174.873 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -134.23 148.68 50.89 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 126.948 2.099 . . . . 0.0 111.184 167.484 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.6 m -108.93 125.33 51.91 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.019 1.328 . . . . 0.0 111.1 175.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 mp -131.42 113.35 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 124.898 1.279 . . . . 0.0 110.145 177.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.68 -94.35 0.16 Allowed Glycine 0 CA--C 1.529 0.955 0 C-N-CA 124.139 0.876 . . . . 0.0 111.888 -177.495 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -114.74 -11.04 12.35 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.809 2.043 . . . . 0.0 113.657 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -112.82 139.88 48.08 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.298 1.039 . . . . 0.0 113.138 -164.84 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 16.8 t -85.75 122.41 29.8 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 125.168 1.387 . . . . 0.0 109.404 164.006 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -121.5 143.58 49.19 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.524 1.53 . . . . 0.0 109.117 172.242 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 10.7 m -99.2 149.35 23.17 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -178.553 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.9 m -140.92 152.26 64.87 Favored Pre-proline 0 N--CA 1.477 0.893 0 C-N-CA 125.032 1.333 . . . . 0.0 113.772 -174.541 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -70.58 170.28 17.94 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 124.221 3.281 . . . . 0.0 112.978 176.217 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 . . . . . 0 C--O 1.251 1.166 0 C-N-CA 125.015 1.326 . . . . 0.0 112.349 176.115 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 . . . . . 0 N--CA 1.465 0.324 0 CA-C-O 120.682 0.277 . . . . 0.0 110.6 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 36.4 tp -58.17 -35.68 71.93 Favored 'General case' 0 C--O 1.223 -0.326 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 -177.437 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.43 -45.12 63.49 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 120.327 1.421 . . . . 0.0 111.704 176.104 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 21.1 ttm180 -63.05 -36.08 82.39 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.364 1.465 . . . . 0.0 112.926 177.287 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 28.1 t -77.75 -41.27 38.19 Favored 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 126.854 2.062 . . . . 0.0 111.03 176.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -58.77 -48.77 80.07 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.165 0.893 . . . . 0.0 111.023 171.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 75.3 mt -63.36 -37.32 86.82 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.704 0.802 . . . . 0.0 112.467 177.181 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 62.9 m -65.75 -51.11 61.89 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.329 0.651 . . . . 0.0 111.821 174.477 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.2 m -69.83 -35.44 74.77 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -179.27 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 36.1 ttm105 -65.85 -25.02 67.01 Favored 'General case' 0 N--CA 1.481 1.106 0 O-C-N 120.846 -1.159 . . . . 0.0 113.078 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.6 p -67.63 -15.65 63.76 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 169.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -104.95 -4.78 21.69 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 125.649 1.579 . . . . 0.0 112.306 175.057 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 97.44 17.31 31.73 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 126.511 2.005 . . . . 0.0 116.348 176.441 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -143.13 177.16 8.57 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 119.439 1.619 . . . . 0.0 113.365 -178.172 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.8 tp -91.23 145.78 24.38 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.196 0.998 . . . . 0.0 111.602 -169.307 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -99.77 141.68 15.59 Favored Glycine 0 N--CA 1.473 1.103 0 O-C-N 121.644 -0.66 . . . . 0.0 113.573 178.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -148.2 126.94 12.57 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 126.409 1.884 . . . . 0.0 109.01 -176.54 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 56.7 m -82.27 133.69 35.25 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.147 -0.971 . . . . 0.0 110.819 -177.048 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 50.5 mt -125.22 118.57 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 123.815 0.846 . . . . 0.0 109.096 175.456 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 68.67 -83.39 0.21 Allowed Glycine 0 CA--C 1.524 0.643 0 C-N-CA 125.709 1.623 . . . . 0.0 111.742 -176.382 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -143.1 3.1 1.35 Allowed 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.075 1.75 . . . . 0.0 112.831 -176.105 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -133.88 158.38 43.58 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.556 1.542 . . . . 0.0 112.751 -172.181 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 41.4 t -87.51 130.28 34.77 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.737 1.215 . . . . 0.0 112.479 -175.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -127.66 159.8 33.58 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 127.14 2.176 . . . . 0.0 109.744 172.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 8.3 m -122.59 141.53 51.6 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -176.642 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.5 m -133.52 157.89 76.92 Favored Pre-proline 0 N--CA 1.475 0.78 0 C-N-CA 126.702 2.001 . . . . 0.0 112.694 -167.464 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.5 154.73 68.38 Favored 'Trans proline' 0 C--O 1.241 0.643 0 C-N-CA 123.367 2.711 . . . . 0.0 112.454 171.326 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 . . . . . 0 C--O 1.252 1.225 0 C-N-CA 126.292 1.837 . . . . 0.0 112.528 175.209 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 . . . . . 0 CA--C 1.537 0.473 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.5 tp -62.8 -35.7 80.74 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-O 117.973 -1.013 . . . . 0.0 112.555 -175.273 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.74 -45.57 82.12 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 120.117 1.326 . . . . 0.0 111.998 173.487 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -60.41 -44.71 95.45 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 123.926 0.89 . . . . 0.0 111.465 176.667 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 33.9 t -68.66 -43.69 75.66 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 124.916 1.286 . . . . 0.0 110.946 178.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -53.84 -52.52 60.12 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 124.015 0.926 . . . . 0.0 110.545 176.087 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 75.7 mt -75.07 -37.64 61.55 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.435 1.094 . . . . 0.0 113.439 -176.335 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.9 m -60.17 -41.17 92.29 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.0 0.818 . . . . 0.0 111.182 170.766 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 73.8 m -71.66 -33.11 68.6 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 171.567 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.55 -35.7 76.67 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 120.74 -1.225 . . . . 0.0 112.382 178.277 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.6 m -62.48 -6.82 3.69 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 174.849 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -115.3 -3.57 12.47 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 125.476 1.511 . . . . 0.0 113.391 174.199 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.26 29.7 8.75 Favored Glycine 0 CA--C 1.541 1.675 0 C-N-CA 125.028 1.299 . . . . 0.0 116.17 175.219 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -150.89 -173.02 4.36 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.413 1.485 . . . . 0.0 112.026 178.702 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 11.1 mp -105.05 156.67 17.84 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.599 1.159 . . . . 0.0 111.726 -175.366 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -112.02 139.98 15.92 Favored Glycine 0 CA--C 1.525 0.675 0 C-N-CA 124.99 1.281 . . . . 0.0 113.155 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -131.12 149.78 52.44 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 126.593 1.957 . . . . 0.0 110.564 177.673 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 27.4 m -101.28 129.38 47.24 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 124.101 0.96 . . . . 0.0 111.98 -174.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 25.2 mt -128.35 90.74 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 124.908 1.283 . . . . 0.0 109.152 -174.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.76 -73.77 0.25 Allowed Glycine 0 CA--C 1.534 1.272 0 C-N-CA 125.964 1.745 . . . . 0.0 114.452 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -135.18 -2.75 2.5 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.684 1.994 . . . . 0.0 112.752 176.432 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -108.14 153.94 22.43 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 127.437 2.295 . . . . 0.0 111.32 -173.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 11.7 t -106.05 130.42 53.97 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.469 1.508 . . . . 0.0 110.064 171.237 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.4 mptt -126.99 148.36 50.1 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.201 1.801 . . . . 0.0 110.418 175.341 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 10.3 m -110.0 124.95 52.35 Favored 'General case' 0 C--O 1.238 0.48 0 C-N-CA 123.818 0.847 . . . . 0.0 111.742 -178.288 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.0 m -99.21 144.91 29.11 Favored Pre-proline 0 N--CA 1.471 0.607 0 C-N-CA 126.008 1.723 . . . . 0.0 113.493 -167.349 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -74.99 117.87 5.07 Favored 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 123.091 2.527 . . . . 0.0 115.048 -153.18 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 . . . . . 0 C--O 1.256 1.43 0 C-N-CA 126.856 2.062 . . . . 0.0 112.554 170.059 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 . . . . . 0 CA--C 1.533 0.311 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.1 tp -67.69 -32.52 73.24 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-O 118.552 -0.737 . . . . 0.0 111.884 -174.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.36 -43.53 98.6 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 119.37 0.986 . . . . 0.0 111.895 174.089 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 32.7 ttp85 -70.98 -36.1 72.38 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 125.38 1.472 . . . . 0.0 112.803 177.428 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 37.7 t -73.33 -39.69 65.05 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 126.003 1.721 . . . . 0.0 111.119 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -57.98 -52.1 66.92 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 123.43 0.692 . . . . 0.0 109.867 171.593 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 76.4 mt -59.31 -41.21 88.51 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 119.275 0.943 . . . . 0.0 112.639 174.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.2 m -64.03 -47.37 80.51 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.861 0.865 . . . . 0.0 112.369 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 93.7 m -73.01 -37.23 67.03 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 177.626 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 40.8 ttm-85 -70.3 -23.47 62.86 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.696 1.198 . . . . 0.0 112.239 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.6 m -63.3 -17.35 62.44 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.26 1.024 . . . . 0.0 113.672 166.093 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.07 -0.19 25.02 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 126.195 1.798 . . . . 0.0 112.547 173.494 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.86 26.86 30.63 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 125.266 1.412 . . . . 0.0 116.169 175.555 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -144.63 -179.69 6.73 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.651 1.581 . . . . 0.0 113.092 176.39 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 21.6 tp -88.19 141.49 28.52 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.581 1.552 . . . . 0.0 111.745 -167.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -93.56 141.88 15.74 Favored Glycine 0 CA--C 1.532 1.135 0 O-C-N 121.931 -0.481 . . . . 0.0 113.82 174.217 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -138.72 151.56 47.25 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.819 2.048 . . . . 0.0 111.758 172.193 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 33.6 m -103.18 114.26 28.41 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.75 1.22 . . . . 0.0 110.094 174.074 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 51.5 mt -141.24 107.8 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 124.92 1.288 . . . . 0.0 110.699 -173.003 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.7 51.28 5.23 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 124.9 1.238 . . . . 0.0 113.282 177.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 79.3 mt-10 57.7 10.43 1.05 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 126.252 1.821 . . . . 0.0 114.655 -171.151 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -133.7 154.73 50.72 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.859 1.663 . . . . 0.0 112.755 -168.124 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 40.0 t -83.07 135.86 34.68 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.39 1.076 . . . . 0.0 111.611 175.398 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 30.7 tptt -142.51 146.88 35.16 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.968 1.707 . . . . 0.0 110.746 176.051 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.0 m -105.56 144.13 32.75 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.8 m -135.35 156.02 78.23 Favored Pre-proline 0 N--CA 1.474 0.77 0 C-N-CA 126.285 1.834 . . . . 0.0 110.916 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -63.13 155.03 63.72 Favored 'Trans proline' 0 CA--C 1.536 0.58 0 C-N-CA 122.568 2.178 . . . . 0.0 112.245 173.349 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 . . . . . 0 C--O 1.251 1.149 0 C-N-CA 124.194 0.998 . . . . 0.0 111.561 171.507 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 . . . . . 0 CA--C 1.537 0.473 0 N-CA-C 108.623 -0.881 . . . . 0.0 108.623 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 42.8 tp -61.76 -38.16 86.96 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 117.924 -1.036 . . . . 0.0 113.0 -175.455 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -69.35 -38.11 77.98 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 120.569 1.532 . . . . 0.0 112.448 176.3 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.5 tmm_? -61.96 -38.89 90.24 Favored 'General case' 0 C--N 1.344 0.369 0 C-N-CA 124.633 1.173 . . . . 0.0 112.999 172.186 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 34.4 t -77.76 -38.73 46.24 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 125.313 1.445 . . . . 0.0 111.404 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -62.31 -45.49 93.03 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.518 0.599 . . . . 0.0 110.294 177.211 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 39.0 tp -62.16 -44.36 96.78 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.722 1.209 . . . . 0.0 112.506 172.474 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.8 m -60.64 -50.3 74.08 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 122.791 0.437 . . . . 0.0 110.934 178.378 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 80.5 m -66.25 -34.97 79.22 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 177.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 55.3 ttm-85 -58.06 -38.01 75.5 Favored 'General case' 0 N--CA 1.479 0.984 0 O-C-N 120.877 -1.14 . . . . 0.0 111.985 173.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 21.2 p -63.01 -17.51 62.28 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 176.002 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 mt -102.39 -10.68 19.24 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.773 1.229 . . . . 0.0 112.603 176.208 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 106.32 20.0 9.5 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 125.755 1.645 . . . . 0.0 116.399 176.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -149.49 -173.19 4.33 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 119.465 1.633 . . . . 0.0 113.169 -177.115 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 26.2 tp -98.25 157.93 15.87 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.256 1.422 . . . . 0.0 111.732 -174.232 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -116.93 147.98 18.88 Favored Glycine 0 N--CA 1.471 1.032 0 N-CA-C 115.251 0.861 . . . . 0.0 115.251 -178.05 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -136.43 153.3 51.11 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 128.168 2.587 . . . . 0.0 110.854 171.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 50.5 m -98.67 115.14 28.03 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.638 1.175 . . . . 0.0 109.566 171.028 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.6 mm -127.77 119.87 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 125.725 1.61 . . . . 0.0 108.965 -176.206 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.22 40.88 92.42 Favored Glycine 0 CA--C 1.533 1.194 0 C-N-CA 123.631 0.634 . . . . 0.0 113.113 -173.059 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 49.32 30.87 3.42 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 127.41 2.284 . . . . 0.0 115.52 -170.336 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -128.09 151.78 48.78 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.796 1.638 . . . . 0.0 110.144 171.3 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 53.4 t -75.52 137.49 40.91 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.468 -0.77 . . . . 0.0 111.136 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -147.92 130.44 15.83 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 127.291 2.237 . . . . 0.0 109.057 -173.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 13.2 m -107.48 146.58 31.59 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 122.581 1.182 . . . . 0.0 113.755 -171.27 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.7 m -138.5 156.94 73.07 Favored Pre-proline 0 N--CA 1.476 0.862 0 C-N-CA 126.703 2.001 . . . . 0.0 111.733 -172.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -64.91 144.49 83.08 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.677 2.251 . . . . 0.0 111.008 169.253 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 52.3 m-85 . . . . . 0 C--O 1.256 1.434 0 C-N-CA 125.288 1.435 . . . . 0.0 113.177 -178.649 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 62.8 t-20 . . . . . 0 C--O 1.237 0.413 0 N-CA-C 109.997 -0.371 . . . . 0.0 109.997 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.8 tp -57.89 -34.96 70.37 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-O 117.763 -1.113 . . . . 0.0 112.74 176.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.88 -38.12 89.92 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 120.439 1.472 . . . . 0.0 112.675 177.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.9 ttm105 -78.84 -28.64 44.34 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 120.88 -1.138 . . . . 0.0 113.058 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 32.5 t -73.11 -41.62 63.83 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 125.372 1.469 . . . . 0.0 109.995 172.227 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -57.87 -46.2 85.21 Favored 'General case' 0 C--O 1.221 -0.409 0 C-N-CA 124.922 1.289 . . . . 0.0 110.0 174.467 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 39.0 tp -62.51 -50.72 70.26 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.232 1.013 . . . . 0.0 112.041 173.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 72.8 m -56.82 -37.87 71.81 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.378 1.071 . . . . 0.0 112.359 -179.064 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 68.8 m -85.12 -37.42 20.26 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 112.994 0.738 . . . . 0.0 112.994 178.262 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 28.9 ttm105 -64.55 -28.82 69.9 Favored 'General case' 0 N--CA 1.479 1.022 0 O-C-N 120.978 -1.076 . . . . 0.0 112.543 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.3 m -62.08 -24.62 67.22 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 170.151 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mt -96.31 -9.66 29.65 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.373 0.988 . . . . 0.0 112.299 176.463 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 101.19 20.42 13.85 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 125.391 1.472 . . . . 0.0 115.77 176.1 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -138.16 -173.25 3.47 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.816 1.646 . . . . 0.0 111.679 176.759 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 79.2 mt -103.93 161.77 13.69 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.334 1.053 . . . . 0.0 112.801 -170.718 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -96.2 151.97 20.09 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 124.348 0.975 . . . . 0.0 114.037 179.144 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.1 tptt -143.1 124.0 14.31 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 126.99 2.116 . . . . 0.0 110.371 173.437 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.6 m -100.02 122.03 42.28 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 123.555 0.742 . . . . 0.0 110.003 176.124 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.4 mp -115.58 99.66 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 176.787 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.48 -94.61 0.03 OUTLIER Glycine 0 CA--C 1.531 1.078 0 C-N-CA 125.84 1.686 . . . . 0.0 113.624 -176.228 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -104.16 -3.87 23.86 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.11 1.364 . . . . 0.0 114.475 -173.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -139.6 152.34 46.74 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 120.459 1.481 . . . . 0.0 113.602 -175.55 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 14.5 t -92.66 135.85 33.74 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.989 2.115 . . . . 0.0 112.703 -179.492 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -122.33 156.83 33.08 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 128.835 2.854 . . . . 0.0 109.23 171.297 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 28.8 m -112.14 141.37 45.91 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 118.895 0.771 . . . . 0.0 112.644 173.498 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.2 m -129.82 151.12 77.62 Favored Pre-proline 0 N--CA 1.471 0.622 0 C-N-CA 126.603 1.961 . . . . 0.0 112.245 -171.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -72.87 158.76 49.55 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.756 2.971 . . . . 0.0 113.696 -178.083 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 . . . . . 0 C--O 1.253 1.276 0 C-N-CA 125.787 1.635 . . . . 0.0 112.464 171.013 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 . . . . . 0 CA--C 1.543 0.697 0 CA-C-O 120.768 0.318 . . . . 0.0 111.111 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 60.8 tp -60.09 -38.32 82.57 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 117.75 -1.119 . . . . 0.0 112.94 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.34 -34.66 78.49 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 120.761 1.619 . . . . 0.0 113.319 179.169 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 48.2 ttp180 -69.15 -39.35 78.85 Favored 'General case' 0 C--N 1.343 0.293 0 C-N-CA 125.564 1.545 . . . . 0.0 111.593 171.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 24.5 t -70.9 -41.59 71.07 Favored 'General case' 0 C--O 1.22 -0.456 0 C-N-CA 125.21 1.404 . . . . 0.0 110.767 178.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -60.0 -50.65 72.92 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.787 1.235 . . . . 0.0 109.658 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 37.0 tp -62.52 -40.9 98.24 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.064 1.346 . . . . 0.0 112.696 176.814 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 71.0 m -62.29 -47.09 85.83 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.915 0.886 . . . . 0.0 111.127 174.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.0 m -72.46 -28.26 62.82 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 178.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.65 -37.23 78.15 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.636 -1.29 . . . . 0.0 113.474 177.684 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 95.1 p -77.03 -2.75 35.6 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.32 1.23 . . . . 0.0 114.32 -178.768 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -110.25 -1.52 17.26 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.47 1.508 . . . . 0.0 112.32 167.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.48 31.92 12.64 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 125.501 1.525 . . . . 0.0 115.706 175.348 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -147.25 -169.97 3.44 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-N 119.796 1.798 . . . . 0.0 114.529 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.0 tp -100.09 148.84 24.12 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.465 1.906 . . . . 0.0 111.538 -168.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -93.58 142.91 16.22 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 124.2 0.905 . . . . 0.0 113.784 176.449 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.0 tptt -132.96 143.35 49.4 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 127.735 2.414 . . . . 0.0 111.442 172.393 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 26.4 t -105.38 113.48 27.09 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 125.472 1.509 . . . . 0.0 109.795 172.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 60.8 mt -135.83 121.7 30.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 124.472 1.109 . . . . 0.0 108.326 -174.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.58 35.47 62.11 Favored Glycine 0 CA--C 1.535 1.31 0 O-C-N 122.104 -0.372 . . . . 0.0 113.508 -177.812 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.257 42.9 mt-10 58.45 20.83 7.82 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 126.499 1.92 . . . . 0.0 115.691 -177.515 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -117.41 155.02 30.35 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.899 1.279 . . . . 0.0 111.732 162.623 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 36.6 t -77.57 135.3 38.16 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.087 0.955 . . . . 0.0 111.357 175.16 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.9 tptp -140.61 128.81 22.29 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 126.029 1.731 . . . . 0.0 108.802 175.09 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 16.5 m -86.45 146.4 26.44 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.843 0.83 . . . . 0.0 112.245 179.231 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.9 m -140.83 161.46 53.98 Favored Pre-proline 0 N--CA 1.473 0.677 0 C-N-CA 127.064 2.145 . . . . 0.0 110.92 -170.224 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.31 153.85 76.32 Favored 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 122.522 2.148 . . . . 0.0 113.866 174.067 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 . . . . . 0 C--O 1.258 1.504 0 C-N-CA 125.746 1.618 . . . . 0.0 111.951 162.43 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 . . . . . 0 CA--C 1.546 0.789 0 CA-C-O 121.046 0.451 . . . . 0.0 111.897 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 55.8 tp -65.02 -39.76 93.87 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 117.736 -1.126 . . . . 0.0 112.948 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.64 -41.06 96.4 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 120.598 1.544 . . . . 0.0 112.28 179.256 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 25.7 ttm180 -67.01 -36.45 82.18 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 126.206 1.803 . . . . 0.0 112.341 175.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 19.8 t -76.15 -38.97 56.06 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 124.776 1.23 . . . . 0.0 111.084 177.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -60.39 -45.17 94.53 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.847 0.859 . . . . 0.0 109.921 173.442 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -60.49 -47.4 86.29 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.253 1.421 . . . . 0.0 111.433 173.334 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.5 m -63.42 -36.87 85.18 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.221 1.008 . . . . 0.0 112.787 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 84.1 m -85.41 -35.51 21.26 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 28.2 ttm105 -69.93 -24.26 63.34 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 120.561 -1.337 . . . . 0.0 112.014 175.013 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 65.6 m -62.44 -15.8 51.49 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 164.481 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 12.0 mt -101.85 -32.81 10.06 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.903 1.228 . . . . 0.0 111.546 173.045 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.6 -4.28 4.0 Favored Glycine 0 CA--C 1.536 1.362 0 C-N-CA 125.19 1.376 . . . . 0.0 115.389 174.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.504 ' H ' HD23 ' A' ' 19' ' ' LEU . 2.4 pt? -119.49 -163.16 0.96 Allowed 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.144 2.178 . . . . 0.0 112.036 -173.697 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.4 mp -108.81 163.36 13.34 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.633 1.573 . . . . 0.0 111.499 -175.308 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -113.35 152.04 18.12 Favored Glycine 0 CA--C 1.536 1.38 0 C-N-CA 125.304 1.43 . . . . 0.0 114.97 -178.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 49.8 mmtt -142.22 152.78 43.43 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 128.752 2.821 . . . . 0.0 111.927 173.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 31.8 m -97.13 108.06 20.71 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.181 1.393 . . . . 0.0 110.421 170.099 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 49.4 mt -131.76 126.07 56.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 125.986 1.714 . . . . 0.0 109.272 -173.057 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 63.25 25.35 68.24 Favored Glycine 0 CA--C 1.54 1.626 0 C-N-CA 123.831 0.729 . . . . 0.0 114.288 -174.477 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 61.55 16.46 7.66 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 127.308 2.243 . . . . 0.0 115.098 -167.445 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -112.7 160.02 18.34 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.273 1.429 . . . . 0.0 111.753 169.506 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 40.8 t -72.22 136.57 46.42 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.405 -0.809 . . . . 0.0 111.38 167.004 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.2 tttt -141.68 141.34 33.34 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 126.666 1.986 . . . . 0.0 110.017 173.406 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.7 m -100.02 149.95 22.94 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.852 -0.53 . . . . 0.0 112.408 -177.705 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.4 m -138.29 147.07 54.16 Favored Pre-proline 0 N--CA 1.476 0.851 0 C-N-CA 125.29 1.436 . . . . 0.0 113.272 -179.336 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -76.1 161.01 36.04 Favored 'Trans proline' 0 CA--C 1.538 0.689 0 C-N-CA 124.632 3.554 . . . . 0.0 112.917 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 18.2 p90 . . . . . 0 C--O 1.25 1.128 0 C-N-CA 125.683 1.593 . . . . 0.0 113.628 179.947 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 53.6 t-20 . . . . . 0 CA--C 1.534 0.357 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 33.3 tp -61.18 -30.72 70.58 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 117.92 -1.038 . . . . 0.0 112.624 -177.822 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.87 -51.59 68.65 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 120.127 1.33 . . . . 0.0 112.053 170.827 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -58.92 -41.64 87.77 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 125.915 1.686 . . . . 0.0 111.909 178.224 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.2 t -70.8 -48.3 54.93 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.033 1.733 . . . . 0.0 111.701 178.386 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.65 -44.44 85.67 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.402 1.081 . . . . 0.0 111.79 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -78.81 -29.43 44.81 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.211 1.404 . . . . 0.0 113.26 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.9 m -74.86 -40.02 61.22 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 118.769 0.713 . . . . 0.0 112.228 173.211 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 84.1 m -66.96 -32.72 74.15 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 118.032 0.378 . . . . 0.0 111.397 169.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -54.0 -38.77 65.45 Favored 'General case' 0 N--CA 1.48 1.026 0 O-C-N 121.016 -1.053 . . . . 0.0 112.897 172.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 73.1 m -72.76 -14.02 61.45 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 115.192 1.553 . . . . 0.0 115.192 -178.263 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.1 mt -95.75 -13.97 23.73 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.462 0.705 . . . . 0.0 111.441 167.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.97 30.67 5.96 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 126.486 1.993 . . . . 0.0 115.065 177.658 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -142.73 -163.47 1.63 Allowed 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 119.808 1.804 . . . . 0.0 113.025 176.469 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.2 mp -108.36 164.64 12.15 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.544 1.938 . . . . 0.0 111.58 -177.345 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -119.8 154.95 16.28 Favored Glycine 0 CA--C 1.538 1.478 0 C-N-CA 124.835 1.207 . . . . 0.0 115.126 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -135.78 152.82 51.5 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 128.257 2.623 . . . . 0.0 111.249 168.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.7 m -114.89 106.71 14.49 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.156 1.382 . . . . 0.0 112.223 176.489 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.716 HG22 ' H ' ' A' ' 25' ' ' GLY . 28.0 mm -87.61 -168.5 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 127.179 2.192 . . . . 0.0 108.486 174.051 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.716 ' H ' HG22 ' A' ' 24' ' ' ILE . . . -57.12 95.68 0.05 OUTLIER Glycine 0 CA--C 1.53 0.972 0 C-N-CA 125.11 1.338 . . . . 0.0 112.768 179.135 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 46.07 30.91 1.02 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 127.6 2.36 . . . . 0.0 114.986 -171.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -140.32 133.8 30.04 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.682 1.193 . . . . 0.0 113.934 -178.304 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 9.6 t -87.62 124.54 33.64 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 125.814 1.646 . . . . 0.0 110.902 175.593 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -119.26 147.97 43.67 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.204 1.802 . . . . 0.0 109.281 174.577 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 19.4 m -106.03 146.48 30.06 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 118.773 0.715 . . . . 0.0 111.533 174.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.6 m -133.51 153.11 80.19 Favored Pre-proline 0 N--CA 1.477 0.914 0 C-N-CA 125.786 1.634 . . . . 0.0 113.916 -169.118 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -66.87 146.0 76.51 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 124.122 3.214 . . . . 0.0 112.537 173.849 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 20.2 p90 . . . . . 0 C--O 1.255 1.372 0 C-N-CA 126.622 1.969 . . . . 0.0 112.707 -169.918 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 . . . . . 0 N--CA 1.469 0.486 0 N-CA-C 110.534 -0.173 . . . . 0.0 110.534 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 59.1 tp -60.38 -41.8 94.53 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 117.625 -1.178 . . . . 0.0 112.402 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.91 -49.73 71.5 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 120.098 1.317 . . . . 0.0 112.164 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.3 ttp-105 -59.94 -40.57 89.37 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 119.329 0.968 . . . . 0.0 112.338 176.522 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 7.2 t -69.96 -45.91 66.4 Favored 'General case' 0 C--O 1.222 -0.363 0 C-N-CA 125.176 1.39 . . . . 0.0 110.532 -179.185 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.42 ' CD ' HH12 ' A' ' 15' ' ' ARG . 4.0 mm-40 -57.08 -49.11 76.89 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 119.098 0.863 . . . . 0.0 111.591 174.676 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 87.3 mt -62.4 -41.44 98.66 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.378 1.071 . . . . 0.0 112.452 177.387 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.9 m -68.13 -42.63 79.91 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.153 0.981 . . . . 0.0 112.2 178.77 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 61.6 m -72.7 -28.63 62.79 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 178.146 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.42 HH12 ' CD ' ' A' ' 11' ' ' GLU . 0.0 OUTLIER -51.38 -43.91 62.01 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.577 1.151 . . . . 0.0 112.453 173.326 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.2 m -69.67 -8.34 46.83 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.36 1.464 . . . . 0.0 114.521 -177.51 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 mt -115.44 -0.49 13.1 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.203 1.401 . . . . 0.0 111.834 178.353 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.42 25.47 21.07 Favored Glycine 0 CA--C 1.535 1.296 0 N-CA-C 116.313 1.285 . . . . 0.0 116.313 173.517 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -148.45 -173.8 4.43 Favored 'General case' 0 CA--C 1.553 1.062 0 CA-C-N 119.197 1.498 . . . . 0.0 114.043 -177.782 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 89.5 mt -92.85 162.5 14.07 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.948 1.699 . . . . 0.0 111.778 -178.273 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -123.47 144.96 15.89 Favored Glycine 0 CA--C 1.533 1.214 0 C-N-CA 124.945 1.26 . . . . 0.0 113.935 177.831 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.93 158.01 43.61 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 125.195 1.398 . . . . 0.0 112.372 170.72 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 18.5 t -89.62 137.91 31.93 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.281 -0.887 . . . . 0.0 110.843 171.755 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 56.3 mt -111.51 99.8 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 169.102 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.06 -73.46 0.18 Allowed Glycine 0 CA--C 1.531 1.079 0 C-N-CA 126.366 1.936 . . . . 0.0 114.289 178.323 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -138.17 13.95 2.83 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 127.05 2.14 . . . . 0.0 113.587 -173.217 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -150.52 146.38 26.56 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 120.2 -1.562 . . . . 0.0 112.727 -170.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 10.3 t -78.31 135.78 37.58 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.077 0.951 . . . . 0.0 111.534 174.487 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -138.56 146.88 42.38 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.469 1.508 . . . . 0.0 110.192 162.591 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.4 m -88.0 153.96 20.87 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.931 -0.481 . . . . 0.0 111.524 176.3 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.6 m -138.13 151.78 70.52 Favored Pre-proline 0 N--CA 1.473 0.713 0 C-N-CA 126.677 1.991 . . . . 0.0 111.561 -171.263 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -74.36 164.98 32.86 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 124.072 3.181 . . . . 0.0 113.695 -169.187 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 . . . . . 0 C--O 1.258 1.524 0 C-N-CA 125.12 1.368 . . . . 0.0 113.043 169.556 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 . . . . . 0 N--CA 1.469 0.509 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 29.6 tp -61.46 -41.15 96.79 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 118.3 -0.857 . . . . 0.0 112.139 -173.567 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.41 -37.41 87.18 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-N 119.798 1.181 . . . . 0.0 113.903 176.274 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 54.3 ttp180 -70.28 -39.61 74.8 Favored 'General case' 0 C--N 1.343 0.305 0 C-N-CA 125.304 1.441 . . . . 0.0 112.284 175.309 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 45.0 t -72.44 -38.55 68.29 Favored 'General case' 0 C--O 1.223 -0.341 0 C-N-CA 125.78 1.632 . . . . 0.0 111.151 179.05 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -56.33 -52.29 65.1 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 124.703 1.201 . . . . 0.0 110.595 175.626 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 44.8 mt -69.57 -37.57 77.05 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.604 0.762 . . . . 0.0 112.944 176.902 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 68.6 m -58.06 -41.05 82.52 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 121.817 -0.552 . . . . 0.0 111.694 171.674 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 83.6 m -75.76 -31.96 59.76 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 173.484 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.12 -35.59 73.72 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 120.63 -1.294 . . . . 0.0 112.261 172.887 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.2 t -60.5 -15.77 30.41 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.716 1.607 . . . . 0.0 113.991 173.603 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.8 mt -110.23 -6.9 14.93 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.297 1.439 . . . . 0.0 112.497 173.791 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.22 23.36 10.53 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 125.623 1.583 . . . . 0.0 116.604 174.216 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -144.82 -173.12 3.98 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 119.091 1.446 . . . . 0.0 113.749 -177.42 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 91.1 mt -92.77 159.3 15.47 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.444 1.498 . . . . 0.0 111.575 -176.431 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -116.06 148.63 18.89 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 124.199 0.904 . . . . 0.0 114.684 -178.817 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -135.83 150.1 49.29 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 127.918 2.487 . . . . 0.0 111.79 172.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 50.6 m -97.15 107.22 19.7 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 123.526 0.731 . . . . 0.0 109.324 168.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.515 HG22 ' H ' ' A' ' 25' ' ' GLY . 45.6 mm -81.85 -177.26 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 164.612 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.515 ' H ' HG22 ' A' ' 24' ' ' ILE . . . -53.52 101.73 0.09 OUTLIER Glycine 0 CA--C 1.534 1.274 0 O-C-N 120.513 -1.367 . . . . 0.0 112.956 -177.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 61.14 7.67 1.69 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 127.97 2.508 . . . . 0.0 116.185 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -137.15 147.89 46.26 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.883 1.673 . . . . 0.0 113.253 -175.381 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 43.0 t -76.85 141.85 40.47 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.058 1.343 . . . . 0.0 111.699 171.065 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.6 tppt? -144.9 148.89 34.41 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 127.964 2.506 . . . . 0.0 108.732 175.679 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 10.5 m -104.41 156.39 17.97 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.3 m -140.18 151.56 64.99 Favored Pre-proline 0 N--CA 1.472 0.654 0 C-N-CA 126.488 1.915 . . . . 0.0 111.485 -176.595 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.49 160.13 50.95 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 124.122 3.215 . . . . 0.0 113.315 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 . . . . . 0 C--O 1.255 1.38 0 C-N-CA 126.098 1.759 . . . . 0.0 113.767 172.51 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 . . . . . 0 CA--C 1.537 0.449 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.4 tp -57.87 -36.89 72.99 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 118.044 -0.979 . . . . 0.0 113.051 -175.436 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.0 -45.3 93.06 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 120.047 1.294 . . . . 0.0 112.646 173.554 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 21.7 ttm180 -65.78 -37.46 86.37 Favored 'General case' 0 C--N 1.346 0.414 0 C-N-CA 125.601 1.561 . . . . 0.0 113.054 175.351 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.6 t -72.44 -43.89 63.16 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 125.669 1.588 . . . . 0.0 110.064 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -59.82 -43.12 94.71 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.836 -0.54 . . . . 0.0 110.81 172.768 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 63.1 mt -64.72 -40.38 95.24 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.066 0.848 . . . . 0.0 113.157 173.111 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.4 m -68.59 -39.23 81.02 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.002 0.921 . . . . 0.0 111.1 -179.388 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.4 m -73.93 -30.08 62.37 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 171.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -62.63 -33.22 74.57 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.196 -1.565 . . . . 0.0 111.908 170.151 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 44.2 m -66.47 -11.87 54.44 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 170.044 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.1 mt -102.72 -19.49 14.73 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 120.458 1.481 . . . . 0.0 112.318 166.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 103.6 30.77 5.13 Favored Glycine 0 CA--C 1.538 1.474 0 C-N-CA 125.789 1.661 . . . . 0.0 115.376 177.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -150.36 -177.59 6.03 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.774 1.23 . . . . 0.0 113.409 178.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.7 tp -83.34 145.82 28.84 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.629 1.572 . . . . 0.0 111.577 -174.544 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -105.53 144.97 15.86 Favored Glycine 0 N--CA 1.472 1.081 0 C-N-CA 123.735 0.684 . . . . 0.0 113.452 175.813 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -137.76 151.54 48.27 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.203 1.801 . . . . 0.0 112.401 175.261 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 75.1 m -96.43 118.66 33.42 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 124.67 1.188 . . . . 0.0 109.787 170.647 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.6 mp -104.48 104.6 17.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 125.538 1.535 . . . . 0.0 107.116 178.679 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.65 -77.1 0.06 OUTLIER Glycine 0 CA--C 1.53 1.008 0 C-N-CA 125.29 1.424 . . . . 0.0 112.83 -167.194 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -142.64 0.8 1.29 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.724 1.609 . . . . 0.0 114.495 -177.203 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -128.03 150.26 50.01 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 119.593 1.088 . . . . 0.0 113.065 -177.681 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 45.0 t -77.85 134.58 37.93 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.761 1.624 . . . . 0.0 112.964 -175.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -141.62 165.88 26.28 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 127.982 2.513 . . . . 0.0 109.709 165.117 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.9 m -114.52 153.94 29.12 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 114.442 1.275 . . . . 0.0 114.442 -175.595 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.3 m -145.92 164.71 23.94 Favored Pre-proline 0 N--CA 1.485 1.309 0 C-N-CA 127.646 2.379 . . . . 0.0 111.665 -177.326 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -66.78 153.25 78.6 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.741 2.294 . . . . 0.0 113.077 172.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 . . . . . 0 C--O 1.25 1.084 0 C-N-CA 126.537 1.935 . . . . 0.0 113.255 177.443 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.444 ' N ' ' HG ' ' A' ' 23' ' ' CYS . 51.1 t-20 . . . . . 0 CA--C 1.539 0.556 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 61.7 tp -49.38 -41.85 40.41 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.597 1.159 . . . . 0.0 111.904 172.273 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.31 -33.62 76.41 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 -176.698 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 60.1 ttt180 -78.62 -43.08 27.16 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 126.546 1.938 . . . . 0.0 111.125 175.158 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 25.1 t -71.07 -41.05 71.2 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 127.353 2.261 . . . . 0.0 112.087 -173.235 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -53.95 -45.28 71.24 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 119.239 0.927 . . . . 0.0 112.773 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.01 -35.24 61.99 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.781 1.232 . . . . 0.0 111.937 -178.079 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 69.2 m -71.72 -35.82 70.3 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.446 0.698 . . . . 0.0 112.755 173.108 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 81.1 m -71.52 -27.75 63.41 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 119.485 1.038 . . . . 0.0 113.145 172.261 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.36 -38.72 66.39 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.323 1.049 . . . . 0.0 113.755 -176.022 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 88.5 p -69.04 -11.85 61.16 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 -175.596 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.1 mt -108.23 1.74 22.27 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.203 1.401 . . . . 0.0 112.1 174.783 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.14 17.83 35.98 Favored Glycine 0 CA--C 1.535 1.283 0 C-N-CA 126.08 1.8 . . . . 0.0 116.372 170.074 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -136.76 -175.05 3.89 Favored 'General case' 0 CA--C 1.551 0.987 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 -171.121 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 70.1 mt -92.83 156.73 16.79 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 126.505 1.922 . . . . 0.0 111.148 -176.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -112.93 150.61 18.41 Favored Glycine 0 N--CA 1.472 1.058 0 C-N-CA 124.247 0.927 . . . . 0.0 114.311 176.415 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -142.76 154.54 44.35 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 127.956 2.502 . . . . 0.0 111.978 170.239 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.444 ' HG ' ' N ' ' A' ' 6' ' ' ASN . 0.8 OUTLIER -118.83 120.7 38.1 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.144 1.778 . . . . 0.0 111.452 -177.976 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.5 mp -141.93 128.33 19.2 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 125.627 1.571 . . . . 0.0 109.722 -177.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.94 44.07 94.64 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 124.396 0.998 . . . . 0.0 114.499 170.093 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.264 4.2 mm-40 62.42 20.54 11.95 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 126.535 1.934 . . . . 0.0 115.273 -175.359 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -131.75 142.9 49.9 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.603 -1.31 . . . . 0.0 113.055 173.097 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 10.2 t -76.84 134.39 39.06 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.805 1.242 . . . . 0.0 111.141 165.341 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.1 ttpt -138.83 138.4 37.48 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.641 1.176 . . . . 0.0 110.45 167.594 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.0 m -96.39 144.49 26.48 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.675 0.79 . . . . 0.0 112.083 -172.025 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.0 m -128.32 151.95 77.25 Favored Pre-proline 0 N--CA 1.473 0.683 0 C-N-CA 126.576 1.95 . . . . 0.0 112.093 -170.44 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.79 151.32 57.2 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.02 2.48 . . . . 0.0 112.625 -176.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 . . . . . 0 C--O 1.251 1.156 0 C-N-CA 124.119 0.967 . . . . 0.0 110.417 165.398 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 . . . . . 0 CA--C 1.535 0.374 0 N-CA-C 105.876 -1.898 . . . . 0.0 105.876 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 51.6 tp -57.53 -37.17 72.6 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.399 -0.81 . . . . 0.0 111.814 -176.523 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.61 -47.84 58.1 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.503 1.047 . . . . 0.0 112.663 -179.352 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.84 -43.31 76.9 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.195 1.398 . . . . 0.0 111.669 176.029 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.7 t -72.81 -50.94 21.03 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 126.959 2.103 . . . . 0.0 110.693 -178.121 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -53.32 -49.63 66.65 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.944 0.898 . . . . 0.0 111.457 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 87.4 mt -74.46 -34.31 63.12 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.476 1.11 . . . . 0.0 113.27 -175.101 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 37.7 m -66.82 -45.96 76.64 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.002 0.521 . . . . 0.0 110.659 170.822 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 73.0 m -58.96 -36.61 75.11 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 122.816 0.446 . . . . 0.0 111.599 171.214 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -34.43 71.85 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 120.623 -1.298 . . . . 0.0 113.422 175.663 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.8 p -66.11 -15.03 62.74 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 174.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.5 mt -102.59 -9.49 20.09 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.509 1.123 . . . . 0.0 112.023 170.292 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 120.42 -9.81 10.82 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 126.782 2.134 . . . . 0.0 116.354 172.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -125.59 -173.14 2.76 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 115.76 1.763 . . . . 0.0 115.76 -159.225 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 79.3 mt -94.01 161.69 14.19 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.222 1.409 . . . . 0.0 111.856 -175.131 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -118.12 137.6 13.2 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 125.343 1.449 . . . . 0.0 113.116 173.483 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.7 mptt -134.07 134.86 42.82 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 127.21 2.204 . . . . 0.0 110.66 174.768 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 29.1 m -75.08 151.68 38.63 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 121.745 0.783 . . . . 0.0 112.261 175.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 30.3 mt -123.83 75.63 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 126.445 1.898 . . . . 0.0 107.556 174.462 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.15 -96.61 0.14 Allowed Glycine 0 CA--C 1.531 1.07 0 CA-C-N 114.337 -1.301 . . . . 0.0 112.193 -170.722 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -98.5 -0.22 43.79 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.374 1.47 . . . . 0.0 114.578 -179.272 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -111.76 168.13 9.81 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 127.687 2.395 . . . . 0.0 111.071 177.718 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 9.2 t -146.13 138.11 25.08 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 120.704 -1.247 . . . . 0.0 114.231 167.179 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 33.7 mmtm -139.06 163.07 33.37 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 126.235 1.814 . . . . 0.0 110.861 -174.088 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 7.5 m -89.09 156.74 18.64 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -177.164 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.4 m -148.58 152.23 37.64 Favored Pre-proline 0 N--CA 1.466 0.359 0 C-N-CA 126.218 1.807 . . . . 0.0 111.92 -176.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -73.07 165.69 32.06 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.39 2.727 . . . . 0.0 112.273 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 . . . . . 0 C--O 1.249 1.068 0 C-N-CA 126.217 1.807 . . . . 0.0 112.272 -178.931 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 . . . . . 0 CA--C 1.534 0.356 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 65.4 tp -64.15 -37.64 88.2 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 117.891 -1.052 . . . . 0.0 112.999 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.39 -46.12 90.06 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 120.208 1.367 . . . . 0.0 111.542 178.209 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -65.85 -39.7 91.0 Favored 'General case' 0 C--N 1.346 0.441 0 C-N-CA 125.076 1.351 . . . . 0.0 112.841 173.869 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 19.7 t -63.13 -48.26 79.27 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 124.988 1.315 . . . . 0.0 110.124 178.014 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -59.88 -47.52 85.42 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.778 0.831 . . . . 0.0 111.104 175.755 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 51.4 mt -61.1 -44.48 97.29 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.968 0.804 . . . . 0.0 112.555 177.008 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 58.7 m -72.51 -41.03 66.38 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.163 0.985 . . . . 0.0 112.367 -178.224 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 77.0 m -64.33 -39.13 93.29 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.109 0.868 . . . . 0.0 110.992 172.237 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.1 ttm105 -67.02 -28.73 68.47 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.074 -1.016 . . . . 0.0 113.106 178.709 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 61.8 m -64.3 -11.14 28.93 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.614 1.339 . . . . 0.0 114.614 168.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.13 2.17 16.61 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 125.251 1.42 . . . . 0.0 112.18 170.522 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 90.94 18.37 47.51 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 126.074 1.797 . . . . 0.0 116.161 173.729 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -136.56 178.24 7.22 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 119.119 1.459 . . . . 0.0 114.344 -176.936 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -94.0 134.06 36.81 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.38 1.872 . . . . 0.0 111.718 -162.375 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -91.83 132.05 11.08 Favored Glycine 0 CA--C 1.532 1.114 0 CA-C-N 118.491 0.587 . . . . 0.0 113.821 179.067 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.5 tppt? -123.9 139.14 54.26 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 126.59 1.956 . . . . 0.0 111.56 176.464 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 7.1 t -105.6 125.63 51.21 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.989 0.915 . . . . 0.0 110.367 175.606 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.0 mt -118.51 82.79 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 125.302 1.441 . . . . 0.0 108.258 -177.016 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.57 -93.82 0.03 OUTLIER Glycine 0 CA--C 1.532 1.152 0 C-N-CA 125.229 1.395 . . . . 0.0 111.798 -167.722 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -96.49 -10.49 27.29 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.165 1.786 . . . . 0.0 114.819 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -105.0 147.6 27.62 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 120.52 1.509 . . . . 0.0 114.463 -175.146 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.4 t -106.52 121.33 44.08 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 124.817 1.247 . . . . 0.0 110.22 171.373 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -125.87 147.84 49.35 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 126.01 1.724 . . . . 0.0 109.971 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 6.9 m -107.49 143.69 35.5 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 122.792 0.437 . . . . 0.0 111.915 173.2 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.6 m -135.21 149.05 68.91 Favored Pre-proline 0 N--CA 1.474 0.769 0 C-N-CA 125.18 1.392 . . . . 0.0 112.603 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -82.84 58.74 6.51 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 124.468 3.446 . . . . 0.0 112.656 -170.792 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 . . . . . 0 C--O 1.252 1.199 0 C-N-CA 127.642 2.377 . . . . 0.0 114.171 -179.44 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 . . . . . 0 CA--C 1.535 0.381 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 41.8 tp -63.65 -33.21 75.11 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 118.232 -0.889 . . . . 0.0 112.657 -175.893 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.27 -44.66 78.77 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 119.52 1.055 . . . . 0.0 112.795 177.746 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -77.49 -29.91 52.79 Favored 'General case' 0 C--N 1.344 0.353 0 C-N-CA 124.148 0.979 . . . . 0.0 113.447 178.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.8 t -68.07 -44.26 76.73 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 124.965 1.306 . . . . 0.0 110.121 170.135 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -57.54 -47.35 82.24 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.879 0.763 . . . . 0.0 110.931 171.19 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.6 tt -57.32 -46.14 83.51 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.832 0.853 . . . . 0.0 111.239 176.314 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 48.8 m -70.35 -47.63 60.11 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.519 1.127 . . . . 0.0 112.82 -178.402 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 70.7 m -63.4 -42.88 98.8 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 118.639 0.654 . . . . 0.0 111.179 175.818 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.5 ttm-85 -74.2 -22.07 59.54 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.745 -1.222 . . . . 0.0 112.651 -177.078 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.8 m -72.19 -16.69 61.97 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 167.536 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.1 mt -89.53 -30.17 18.41 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.271 0.941 . . . . 0.0 111.333 163.222 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 128.28 12.88 2.73 Favored Glycine 0 CA--C 1.536 1.372 0 C-N-CA 125.672 1.606 . . . . 0.0 115.744 173.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -135.4 173.57 11.57 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 119.609 1.704 . . . . 0.0 114.595 -172.392 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.8 tp -84.87 135.85 33.9 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.379 1.471 . . . . 0.0 111.544 -167.599 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.58 137.99 15.86 Favored Glycine 0 CA--C 1.538 1.494 0 CA-C-N 118.725 0.693 . . . . 0.0 113.299 170.91 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.11 128.21 22.3 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.014 1.726 . . . . 0.0 113.878 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 6.7 t -91.63 133.42 35.58 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.265 1.426 . . . . 0.0 111.587 -179.292 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 13.1 mt -138.98 112.97 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.751 1.221 . . . . 0.0 110.396 -175.883 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.11 -100.76 0.43 Allowed Glycine 0 CA--C 1.53 1.017 0 N-CA-C 110.558 -1.017 . . . . 0.0 110.558 -168.616 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -126.99 7.95 6.69 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 126.671 1.988 . . . . 0.0 113.965 176.833 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -123.61 150.14 44.49 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.707 1.203 . . . . 0.0 110.258 -178.664 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.1 t -105.44 145.98 30.12 Favored 'General case' 0 CA--C 1.537 0.481 0 O-C-N 121.372 -0.83 . . . . 0.0 112.581 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -122.16 163.42 19.56 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 128.193 2.597 . . . . 0.0 109.839 174.457 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.9 m -106.34 149.18 27.21 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 122.056 -0.403 . . . . 0.0 111.598 163.021 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.2 m -142.4 156.09 64.03 Favored Pre-proline 0 N--CA 1.479 0.995 0 C-N-CA 124.999 1.32 . . . . 0.0 113.714 -172.81 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -84.5 51.55 3.3 Favored 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 124.987 3.791 . . . . 0.0 113.056 -172.749 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 . . . . . 0 C--O 1.252 1.229 0 C-N-CA 126.577 1.951 . . . . 0.0 113.604 -178.062 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 . . . . . 0 CA--C 1.534 0.361 0 N-CA-C 106.697 -1.594 . . . . 0.0 106.697 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 29.7 tp -59.22 -40.86 87.18 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.754 1.161 . . . . 0.0 112.438 -173.184 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.7 -48.49 81.54 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 119.488 1.04 . . . . 0.0 112.433 178.37 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -60.07 -43.42 95.47 Favored 'General case' 0 C--N 1.346 0.432 0 C-N-CA 125.645 1.578 . . . . 0.0 112.832 172.614 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 7.9 t -77.38 -43.38 32.96 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 124.986 1.314 . . . . 0.0 111.44 -169.58 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -58.72 -44.49 90.43 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.823 1.192 . . . . 0.0 111.162 171.586 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 79.1 mt -64.55 -38.5 91.22 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 175.57 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 63.0 m -79.1 -32.38 44.6 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.763 1.225 . . . . 0.0 113.116 -179.24 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 58.6 m -73.33 -27.29 61.44 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 119.009 -0.519 . . . . 0.0 111.129 169.141 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -35.79 75.33 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 119.836 1.198 . . . . 0.0 112.944 167.658 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.7 m -63.51 -19.94 65.19 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.222 1.009 . . . . 0.0 113.083 174.632 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 21.0 mt -100.2 -27.24 13.62 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.28 1.432 . . . . 0.0 112.349 172.445 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 105.33 17.97 12.83 Favored Glycine 0 CA--C 1.539 1.59 0 C-N-CA 126.199 1.857 . . . . 0.0 115.911 178.725 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -134.56 -177.56 4.66 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.382 1.591 . . . . 0.0 113.13 -175.324 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 30.3 tp -91.27 140.83 29.42 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.121 1.768 . . . . 0.0 112.706 -165.896 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -92.14 141.71 15.72 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 124.817 1.199 . . . . 0.0 115.938 -178.035 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.3 tppt? -143.53 173.62 11.48 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 128.054 2.542 . . . . 0.0 112.927 176.382 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 35.8 t -126.2 144.73 50.66 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.526 1.53 . . . . 0.0 110.864 174.736 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 55.6 mt -135.54 118.16 22.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 124.288 1.035 . . . . 0.0 108.348 166.075 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.23 -79.92 0.63 Allowed Glycine 0 N--CA 1.472 1.055 0 C-N-CA 124.327 0.965 . . . . 0.0 114.412 171.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -150.83 18.42 0.79 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 127.833 2.453 . . . . 0.0 112.003 176.019 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -120.45 145.37 47.31 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.429 2.292 . . . . 0.0 112.663 -177.701 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 2.1 t -83.88 132.36 34.8 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 124.946 1.298 . . . . 0.0 110.06 169.101 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -136.31 131.4 34.3 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.75 1.22 . . . . 0.0 110.319 -177.594 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 6.3 m -99.19 144.27 28.51 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.182 0.593 . . . . 0.0 111.796 177.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.0 m -134.65 155.19 79.72 Favored Pre-proline 0 N--CA 1.474 0.756 0 C-N-CA 125.921 1.689 . . . . 0.0 112.702 -177.676 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -71.38 161.99 43.81 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.719 2.946 . . . . 0.0 112.659 174.246 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 83.7 m-85 . . . . . 0 C--O 1.251 1.143 0 C-N-CA 125.421 1.488 . . . . 0.0 114.065 -176.238 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 55.2 t-20 . . . . . 0 CA--C 1.536 0.406 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 42.3 tp -52.26 -41.12 62.55 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.071 0.948 . . . . 0.0 112.647 177.368 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.25 90.27 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 118.939 0.79 . . . . 0.0 112.91 -177.25 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 59.7 ttt180 -71.42 -43.21 67.18 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.701 1.6 . . . . 0.0 111.401 174.277 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 19.7 t -68.46 -40.06 81.19 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 126.442 1.897 . . . . 0.0 112.007 -176.005 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -60.05 -44.11 94.9 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.802 0.728 . . . . 0.0 112.299 178.379 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -74.16 -33.98 63.68 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.75 0.82 . . . . 0.0 112.448 177.049 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 28.4 m -65.49 -47.28 76.59 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 121.601 -0.687 . . . . 0.0 111.87 172.634 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.2 m -70.81 -34.54 71.84 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 118.735 0.698 . . . . 0.0 112.594 177.6 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 41.9 ttm180 -54.91 -34.35 63.04 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 121.289 -0.882 . . . . 0.0 111.161 168.229 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.3 m -77.54 0.58 22.4 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 176.498 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.2 mt -115.92 -3.83 12.12 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 125.278 1.431 . . . . 0.0 112.075 165.119 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.43 19.02 31.23 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 125.733 1.635 . . . . 0.0 116.383 175.877 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -143.78 -172.05 3.66 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.367 1.467 . . . . 0.0 112.89 -179.35 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 20.5 tp -94.25 150.77 19.99 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.461 1.504 . . . . 0.0 111.901 -168.303 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -106.04 142.81 15.65 Favored Glycine 0 CA--C 1.532 1.113 0 O-C-N 121.424 -0.797 . . . . 0.0 114.523 177.252 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -142.64 160.94 39.32 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 128.031 2.532 . . . . 0.0 111.036 169.747 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 4.7 t -97.44 138.09 35.42 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.762 -0.586 . . . . 0.0 111.387 167.006 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 55.1 mt -126.49 116.04 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 125.358 1.463 . . . . 0.0 108.848 168.804 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.41 -96.65 0.15 Allowed Glycine 0 CA--C 1.532 1.127 0 C-N-CA 125.064 1.316 . . . . 0.0 112.453 -176.101 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -125.33 18.89 8.23 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 125.956 1.702 . . . . 0.0 113.62 178.386 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -129.61 145.27 51.5 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.295 1.438 . . . . 0.0 112.861 -174.74 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 9.6 t -74.95 128.11 34.79 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.231 0.613 . . . . 0.0 109.84 160.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -130.45 132.7 45.83 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.306 1.442 . . . . 0.0 108.776 174.559 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 22.5 m -92.84 139.7 30.27 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 120.787 0.327 . . . . 0.0 111.687 -177.443 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.7 m -127.34 152.69 76.61 Favored Pre-proline 0 N--CA 1.469 0.517 0 C-N-CA 126.011 1.725 . . . . 0.0 110.984 -168.603 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -63.24 158.93 41.83 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.287 2.658 . . . . 0.0 112.365 -177.158 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 . . . . . 0 C--O 1.253 1.262 0 C-N-CA 124.576 1.151 . . . . 0.0 109.765 159.591 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.714 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 77.6 p -66.95 -22.56 65.93 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 118.529 1.165 . . . . 0.0 112.091 169.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -126.8 158.37 36.76 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 126.613 1.965 . . . . 0.0 109.539 170.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -144.96 103.59 3.9 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.71 1.204 . . . . 0.0 111.024 176.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 50.2 t -62.72 143.8 57.06 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.38 0.672 . . . . 0.0 111.597 170.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -119.54 115.4 23.95 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.09 1.756 . . . . 0.0 108.339 172.115 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 53.9 tp -58.26 -45.25 88.16 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-O 117.909 -1.043 . . . . 0.0 112.316 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.2 -39.81 79.92 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 120.208 1.367 . . . . 0.0 112.957 175.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 32.5 ttp180 -78.16 -33.94 49.97 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.291 1.437 . . . . 0.0 113.379 -179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 35.6 t -69.19 -40.82 77.82 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 126.062 1.745 . . . . 0.0 109.933 171.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -61.64 -44.72 96.45 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.291 1.037 . . . . 0.0 111.639 175.149 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 26.8 mt -66.77 -28.72 68.62 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.177 1.391 . . . . 0.0 113.62 173.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 63.1 m -77.93 -47.78 17.83 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.729 1.212 . . . . 0.0 112.085 175.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 68.4 m -67.49 -31.6 71.85 Favored 'General case' 0 CA--C 1.549 0.91 0 O-C-N 121.248 -0.908 . . . . 0.0 111.774 178.131 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 42.4 ttm-85 -53.64 -32.95 53.5 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.529 1.532 . . . . 0.0 112.964 166.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.0 m -71.46 -16.74 62.38 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 114.301 1.222 . . . . 0.0 114.301 177.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.1 mt -108.27 -11.06 15.28 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.401 1.08 . . . . 0.0 112.459 175.706 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 98.42 27.19 8.77 Favored Glycine 0 CA--C 1.537 1.407 0 C-N-CA 125.621 1.581 . . . . 0.0 115.635 174.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -145.28 178.64 7.94 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 119.232 1.516 . . . . 0.0 112.725 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.3 tp -86.78 148.57 25.35 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.913 1.285 . . . . 0.0 111.639 -170.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -100.09 143.24 16.28 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 123.915 0.769 . . . . 0.0 114.099 173.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.13 157.4 44.93 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 127.344 2.258 . . . . 0.0 110.474 169.281 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 85.7 m -100.19 133.71 44.18 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.417 -0.802 . . . . 0.0 110.533 171.136 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 71.6 mt -138.5 125.14 25.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.181 1.393 . . . . 0.0 108.617 177.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.63 33.2 76.21 Favored Glycine 0 CA--C 1.539 1.552 0 O-C-N 121.487 -0.758 . . . . 0.0 114.265 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 60.72 21.11 11.13 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 127.043 2.137 . . . . 0.0 114.907 -172.146 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -120.72 152.5 38.19 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.156 1.783 . . . . 0.0 110.953 173.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 33.2 t -76.75 131.02 38.5 Favored 'General case' 0 C--O 1.241 0.657 0 O-C-N 121.593 -0.692 . . . . 0.0 110.525 176.228 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 42.9 tttt -139.35 127.61 22.67 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.729 1.212 . . . . 0.0 109.974 175.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 12.5 m -89.79 151.79 21.62 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.606 -177.429 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.4 m -141.05 150.55 59.47 Favored Pre-proline 0 N--CA 1.474 0.737 0 C-N-CA 124.883 1.273 . . . . 0.0 113.112 -175.54 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -79.19 65.89 8.82 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 124.66 3.574 . . . . 0.0 112.845 -175.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 . . . . . 0 C--O 1.253 1.261 0 C-N-CA 128.404 2.682 . . . . 0.0 114.159 -179.932 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.14 0 N-CA-C 112.067 -0.413 . . . . 0.0 112.067 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.5 t -148.9 23.26 0.97 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.448 1.099 . . . . 0.0 113.561 176.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -84.6 7.07 21.43 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 115.985 1.846 . . . . 0.0 115.985 -165.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 31.4 t80 46.35 48.09 13.6 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 125.356 1.463 . . . . 0.0 111.884 -167.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.5 t -80.27 142.18 34.82 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 126.038 1.735 . . . . 0.0 112.098 -167.024 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -141.35 150.77 42.87 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.308 1.443 . . . . 0.0 108.674 167.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 44.4 tp -53.91 -40.53 66.76 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 119.275 0.943 . . . . 0.0 112.001 167.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.29 -42.07 84.35 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.703 1.138 . . . . 0.0 112.981 177.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 31.8 mtp180 -69.13 -36.25 77.27 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.658 1.183 . . . . 0.0 112.386 177.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 16.0 t -78.0 -36.38 48.87 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 125.694 1.598 . . . . 0.0 110.854 178.122 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -55.09 -47.61 74.7 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.58 0.752 . . . . 0.0 111.258 167.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 53.5 mt -63.14 -50.73 69.27 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.222 0.609 . . . . 0.0 111.884 174.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 44.4 m -64.02 -43.51 95.37 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -176.565 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 78.6 m -65.44 -35.17 80.12 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.189 0.904 . . . . 0.0 112.631 173.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 26.4 ttm105 -69.77 -19.59 63.51 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 120.994 -1.066 . . . . 0.0 113.046 178.18 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.2 p -62.92 -31.1 72.1 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 118.569 0.622 . . . . 0.0 112.511 166.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 mt -91.31 -6.04 53.73 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.531 1.132 . . . . 0.0 112.555 173.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.24 12.46 39.07 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 126.623 2.059 . . . . 0.0 115.916 174.368 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -134.79 -177.71 4.75 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 120.08 1.94 . . . . 0.0 113.473 -175.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 80.6 mt -94.14 164.03 13.22 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.6 1.16 . . . . 0.0 111.894 -169.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -117.3 146.54 18.78 Favored Glycine 0 N--CA 1.474 1.225 0 N-CA-C 116.119 1.208 . . . . 0.0 116.119 -171.191 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 57.4 mmtt -133.9 134.38 42.6 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 127.348 2.259 . . . . 0.0 111.664 165.565 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 53.6 t -114.0 109.53 18.61 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.916 1.286 . . . . 0.0 109.925 -177.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 36.9 mm -140.14 127.06 23.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 124.475 1.11 . . . . 0.0 109.723 -167.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.29 29.72 75.8 Favored Glycine 0 CA--C 1.536 1.371 0 CA-C-O 119.379 -0.678 . . . . 0.0 114.609 177.321 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 62.46 29.32 17.11 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.933 1.693 . . . . 0.0 114.484 -175.133 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -135.41 155.03 51.22 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.569 1.948 . . . . 0.0 109.917 168.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 10.0 t -107.77 135.38 49.29 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.32 1.048 . . . . 0.0 112.321 -175.279 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 66.1 mmtt -136.83 153.62 50.74 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 127.156 2.182 . . . . 0.0 111.307 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 12.3 m -115.95 149.35 38.89 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 -174.17 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.3 m -138.6 156.97 72.9 Favored Pre-proline 0 N--CA 1.481 1.087 0 C-N-CA 127.051 2.14 . . . . 0.0 113.07 -170.338 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -83.44 165.37 14.34 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 124.069 3.179 . . . . 0.0 114.684 -173.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 . . . . . 0 C--O 1.256 1.402 0 C-N-CA 125.53 1.532 . . . . 0.0 112.012 167.595 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.12 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.4 m -100.82 -10.5 20.67 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.833 1.42 . . . . 0.0 114.833 -173.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 57.75 139.95 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 118.426 2.75 . . . . 0.0 118.426 178.019 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.1 t80 43.21 66.34 0.81 Allowed 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 127.566 2.346 . . . . 0.0 113.999 164.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 11.5 t -67.33 128.64 37.17 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.547 -0.751 . . . . 0.0 112.435 -165.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 45.3 t30 -115.42 114.04 24.54 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.425 1.09 . . . . 0.0 110.225 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 46.7 tp -57.67 -34.44 69.39 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 118.719 -0.658 . . . . 0.0 112.137 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.23 -46.63 87.96 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 118.975 0.807 . . . . 0.0 112.686 176.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 18.7 ttt180 -66.12 -45.02 82.59 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 126.038 1.735 . . . . 0.0 111.994 175.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 49.7 t -65.55 -44.66 86.15 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 125.402 1.481 . . . . 0.0 111.222 -176.487 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -54.64 -52.02 63.6 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.562 0.745 . . . . 0.0 111.16 176.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 16.6 tp -73.76 -28.25 61.58 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.662 1.185 . . . . 0.0 113.299 -176.033 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.4 m -73.4 -47.53 41.19 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.678 0.791 . . . . 0.0 110.867 173.287 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 95.7 m -60.89 -31.55 71.04 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 171.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -52.82 -32.2 42.96 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.355 1.062 . . . . 0.0 113.649 173.752 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 54.6 p -63.58 -24.27 67.73 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.3 mt -97.71 -8.75 27.99 Favored 'General case' 0 N--CA 1.477 0.903 0 O-C-N 121.047 -1.033 . . . . 0.0 112.22 174.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 111.47 6.6 25.2 Favored Glycine 0 CA--C 1.532 1.156 0 C-N-CA 126.716 2.103 . . . . 0.0 115.586 172.417 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -130.01 -172.04 2.68 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 119.972 1.886 . . . . 0.0 114.953 -167.089 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.2 mt -92.9 157.69 16.23 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.306 1.442 . . . . 0.0 111.203 -176.008 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -110.39 147.96 17.49 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 124.911 1.243 . . . . 0.0 113.941 174.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -134.23 148.68 50.89 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 126.948 2.099 . . . . 0.0 111.184 167.484 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.6 m -108.93 125.33 51.91 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.019 1.328 . . . . 0.0 111.1 175.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 mp -131.42 113.35 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 124.898 1.279 . . . . 0.0 110.145 177.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.68 -94.35 0.16 Allowed Glycine 0 CA--C 1.529 0.955 0 C-N-CA 124.139 0.876 . . . . 0.0 111.888 -177.495 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -114.74 -11.04 12.35 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.809 2.043 . . . . 0.0 113.657 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -112.82 139.88 48.08 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.298 1.039 . . . . 0.0 113.138 -164.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 16.8 t -85.75 122.41 29.8 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 125.168 1.387 . . . . 0.0 109.404 164.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -121.5 143.58 49.19 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.524 1.53 . . . . 0.0 109.117 172.242 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 10.7 m -99.2 149.35 23.17 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -178.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.9 m -140.92 152.26 64.87 Favored Pre-proline 0 N--CA 1.477 0.893 0 C-N-CA 125.032 1.333 . . . . 0.0 113.772 -174.541 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -70.58 170.28 17.94 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 124.221 3.281 . . . . 0.0 112.978 176.217 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 . . . . . 0 C--O 1.251 1.166 0 C-N-CA 125.015 1.326 . . . . 0.0 112.349 176.115 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.12 0 CA-C-O 119.56 -0.578 . . . . 0.0 111.756 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.0 p -91.51 -18.13 24.61 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 115.714 1.746 . . . . 0.0 115.714 -164.125 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -157.12 165.92 34.7 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.915 1.286 . . . . 0.0 111.108 -175.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -132.22 80.06 1.89 Allowed 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.141 1.376 . . . . 0.0 112.979 -169.117 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 35.8 t -78.81 144.73 34.8 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.42 -0.8 . . . . 0.0 111.992 173.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -133.55 131.65 39.98 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 124.519 1.128 . . . . 0.0 110.6 172.242 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 36.4 tp -58.17 -35.68 71.93 Favored 'General case' 0 C--O 1.223 -0.326 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 -177.437 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.43 -45.12 63.49 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 120.327 1.421 . . . . 0.0 111.704 176.104 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 21.1 ttm180 -63.05 -36.08 82.39 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.364 1.465 . . . . 0.0 112.926 177.287 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 28.1 t -77.75 -41.27 38.19 Favored 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 126.854 2.062 . . . . 0.0 111.03 176.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -58.77 -48.77 80.07 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.165 0.893 . . . . 0.0 111.023 171.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 75.3 mt -63.36 -37.32 86.82 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.704 0.802 . . . . 0.0 112.467 177.181 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 62.9 m -65.75 -51.11 61.89 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.329 0.651 . . . . 0.0 111.821 174.477 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.2 m -69.83 -35.44 74.77 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -179.27 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 36.1 ttm105 -65.85 -25.02 67.01 Favored 'General case' 0 N--CA 1.481 1.106 0 O-C-N 120.846 -1.159 . . . . 0.0 113.078 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.6 p -67.63 -15.65 63.76 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 169.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -104.95 -4.78 21.69 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 125.649 1.579 . . . . 0.0 112.306 175.057 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 97.44 17.31 31.73 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 126.511 2.005 . . . . 0.0 116.348 176.441 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -143.13 177.16 8.57 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 119.439 1.619 . . . . 0.0 113.365 -178.172 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.8 tp -91.23 145.78 24.38 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.196 0.998 . . . . 0.0 111.602 -169.307 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -99.77 141.68 15.59 Favored Glycine 0 N--CA 1.473 1.103 0 O-C-N 121.644 -0.66 . . . . 0.0 113.573 178.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -148.2 126.94 12.57 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 126.409 1.884 . . . . 0.0 109.01 -176.54 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 56.7 m -82.27 133.69 35.25 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.147 -0.971 . . . . 0.0 110.819 -177.048 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 50.5 mt -125.22 118.57 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 123.815 0.846 . . . . 0.0 109.096 175.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 68.67 -83.39 0.21 Allowed Glycine 0 CA--C 1.524 0.643 0 C-N-CA 125.709 1.623 . . . . 0.0 111.742 -176.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -143.1 3.1 1.35 Allowed 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.075 1.75 . . . . 0.0 112.831 -176.105 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -133.88 158.38 43.58 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.556 1.542 . . . . 0.0 112.751 -172.181 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 41.4 t -87.51 130.28 34.77 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.737 1.215 . . . . 0.0 112.479 -175.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -127.66 159.8 33.58 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 127.14 2.176 . . . . 0.0 109.744 172.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 8.3 m -122.59 141.53 51.6 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -176.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.5 m -133.52 157.89 76.92 Favored Pre-proline 0 N--CA 1.475 0.78 0 C-N-CA 126.702 2.001 . . . . 0.0 112.694 -167.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.5 154.73 68.38 Favored 'Trans proline' 0 C--O 1.241 0.643 0 C-N-CA 123.367 2.711 . . . . 0.0 112.454 171.326 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 . . . . . 0 C--O 1.252 1.225 0 C-N-CA 126.292 1.837 . . . . 0.0 112.528 175.209 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.184 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 89.8 p -164.38 150.7 10.92 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.937 1.695 . . . . 0.0 110.332 179.138 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -133.77 31.49 3.64 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 129.1 2.96 . . . . 0.0 112.54 6.518 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 71.0 t80 48.62 117.97 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 128.331 2.652 . . . . 0.0 115.215 -166.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 25.7 t -90.16 119.26 30.34 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 120.62 -1.3 . . . . 0.0 112.064 -179.047 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -99.7 119.86 38.78 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 126.932 2.093 . . . . 0.0 107.604 168.103 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.5 tp -62.8 -35.7 80.74 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-O 117.973 -1.013 . . . . 0.0 112.555 -175.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.74 -45.57 82.12 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 120.117 1.326 . . . . 0.0 111.998 173.487 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -60.41 -44.71 95.45 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 123.926 0.89 . . . . 0.0 111.465 176.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 33.9 t -68.66 -43.69 75.66 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 124.916 1.286 . . . . 0.0 110.946 178.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -53.84 -52.52 60.12 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 124.015 0.926 . . . . 0.0 110.545 176.087 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 75.7 mt -75.07 -37.64 61.55 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.435 1.094 . . . . 0.0 113.439 -176.335 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.9 m -60.17 -41.17 92.29 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.0 0.818 . . . . 0.0 111.182 170.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 73.8 m -71.66 -33.11 68.6 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 171.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.55 -35.7 76.67 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 120.74 -1.225 . . . . 0.0 112.382 178.277 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.6 m -62.48 -6.82 3.69 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 174.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -115.3 -3.57 12.47 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 125.476 1.511 . . . . 0.0 113.391 174.199 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.26 29.7 8.75 Favored Glycine 0 CA--C 1.541 1.675 0 C-N-CA 125.028 1.299 . . . . 0.0 116.17 175.219 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -150.89 -173.02 4.36 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.413 1.485 . . . . 0.0 112.026 178.702 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 11.1 mp -105.05 156.67 17.84 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.599 1.159 . . . . 0.0 111.726 -175.366 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -112.02 139.98 15.92 Favored Glycine 0 CA--C 1.525 0.675 0 C-N-CA 124.99 1.281 . . . . 0.0 113.155 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -131.12 149.78 52.44 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 126.593 1.957 . . . . 0.0 110.564 177.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 27.4 m -101.28 129.38 47.24 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 124.101 0.96 . . . . 0.0 111.98 -174.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 25.2 mt -128.35 90.74 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 124.908 1.283 . . . . 0.0 109.152 -174.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.76 -73.77 0.25 Allowed Glycine 0 CA--C 1.534 1.272 0 C-N-CA 125.964 1.745 . . . . 0.0 114.452 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -135.18 -2.75 2.5 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.684 1.994 . . . . 0.0 112.752 176.432 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -108.14 153.94 22.43 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 127.437 2.295 . . . . 0.0 111.32 -173.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 11.7 t -106.05 130.42 53.97 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.469 1.508 . . . . 0.0 110.064 171.237 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.4 mptt -126.99 148.36 50.1 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.201 1.801 . . . . 0.0 110.418 175.341 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 10.3 m -110.0 124.95 52.35 Favored 'General case' 0 C--O 1.238 0.48 0 C-N-CA 123.818 0.847 . . . . 0.0 111.742 -178.288 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.0 m -99.21 144.91 29.11 Favored Pre-proline 0 N--CA 1.471 0.607 0 C-N-CA 126.008 1.723 . . . . 0.0 113.493 -167.349 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -74.99 117.87 5.07 Favored 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 123.091 2.527 . . . . 0.0 115.048 -153.18 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 . . . . . 0 C--O 1.256 1.43 0 C-N-CA 126.856 2.062 . . . . 0.0 112.554 170.059 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.18 0 N-CA-C 111.951 -0.46 . . . . 0.0 111.951 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.5 -26.22 59.86 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.193 0.997 . . . . 0.0 112.558 170.353 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -150.89 176.95 10.6 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 127.613 2.365 . . . . 0.0 108.66 166.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 11.6 p90 -141.79 139.13 32.69 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 125.062 1.345 . . . . 0.0 109.99 170.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 30.0 t -86.99 141.59 28.56 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.605 1.562 . . . . 0.0 110.333 171.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -107.12 113.72 27.34 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.838 0.855 . . . . 0.0 109.251 173.544 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.1 tp -67.69 -32.52 73.24 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-O 118.552 -0.737 . . . . 0.0 111.884 -174.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.36 -43.53 98.6 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 119.37 0.986 . . . . 0.0 111.895 174.089 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 32.7 ttp85 -70.98 -36.1 72.38 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 125.38 1.472 . . . . 0.0 112.803 177.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 37.7 t -73.33 -39.69 65.05 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 126.003 1.721 . . . . 0.0 111.119 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -57.98 -52.1 66.92 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 123.43 0.692 . . . . 0.0 109.867 171.593 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 76.4 mt -59.31 -41.21 88.51 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 119.275 0.943 . . . . 0.0 112.639 174.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.2 m -64.03 -47.37 80.51 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.861 0.865 . . . . 0.0 112.369 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 93.7 m -73.01 -37.23 67.03 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 177.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 40.8 ttm-85 -70.3 -23.47 62.86 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.696 1.198 . . . . 0.0 112.239 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.6 m -63.3 -17.35 62.44 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.26 1.024 . . . . 0.0 113.672 166.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.07 -0.19 25.02 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 126.195 1.798 . . . . 0.0 112.547 173.494 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.86 26.86 30.63 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 125.266 1.412 . . . . 0.0 116.169 175.555 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -144.63 -179.69 6.73 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.651 1.581 . . . . 0.0 113.092 176.39 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 21.6 tp -88.19 141.49 28.52 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.581 1.552 . . . . 0.0 111.745 -167.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -93.56 141.88 15.74 Favored Glycine 0 CA--C 1.532 1.135 0 O-C-N 121.931 -0.481 . . . . 0.0 113.82 174.217 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -138.72 151.56 47.25 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.819 2.048 . . . . 0.0 111.758 172.193 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 33.6 m -103.18 114.26 28.41 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.75 1.22 . . . . 0.0 110.094 174.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 51.5 mt -141.24 107.8 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 124.92 1.288 . . . . 0.0 110.699 -173.003 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.7 51.28 5.23 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 124.9 1.238 . . . . 0.0 113.282 177.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 79.3 mt-10 57.7 10.43 1.05 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 126.252 1.821 . . . . 0.0 114.655 -171.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -133.7 154.73 50.72 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.859 1.663 . . . . 0.0 112.755 -168.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 40.0 t -83.07 135.86 34.68 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.39 1.076 . . . . 0.0 111.611 175.398 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 30.7 tptt -142.51 146.88 35.16 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.968 1.707 . . . . 0.0 110.746 176.051 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.0 m -105.56 144.13 32.75 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.8 m -135.35 156.02 78.23 Favored Pre-proline 0 N--CA 1.474 0.77 0 C-N-CA 126.285 1.834 . . . . 0.0 110.916 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -63.13 155.03 63.72 Favored 'Trans proline' 0 CA--C 1.536 0.58 0 C-N-CA 122.568 2.178 . . . . 0.0 112.245 173.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 . . . . . 0 C--O 1.251 1.149 0 C-N-CA 124.194 0.998 . . . . 0.0 111.561 171.507 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.932 0 N-CA-C 110.353 -1.099 . . . . 0.0 110.353 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.5 m -85.55 4.87 34.02 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -173.286 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 54.32 5.27 0.08 Allowed 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 119.503 3.149 . . . . 0.0 119.503 177.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -145.53 76.42 1.47 Allowed 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 120.917 1.69 . . . . 0.0 114.492 -171.077 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 36.5 t -139.13 141.48 38.08 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.266 -0.896 . . . . 0.0 112.607 163.233 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -123.51 130.92 53.39 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.695 1.598 . . . . 0.0 108.623 166.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 42.8 tp -61.76 -38.16 86.96 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 117.924 -1.036 . . . . 0.0 113.0 -175.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -69.35 -38.11 77.98 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 120.569 1.532 . . . . 0.0 112.448 176.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.5 tmm_? -61.96 -38.89 90.24 Favored 'General case' 0 C--N 1.344 0.369 0 C-N-CA 124.633 1.173 . . . . 0.0 112.999 172.186 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 34.4 t -77.76 -38.73 46.24 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 125.313 1.445 . . . . 0.0 111.404 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -62.31 -45.49 93.03 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.518 0.599 . . . . 0.0 110.294 177.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 39.0 tp -62.16 -44.36 96.78 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.722 1.209 . . . . 0.0 112.506 172.474 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.8 m -60.64 -50.3 74.08 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 122.791 0.437 . . . . 0.0 110.934 178.378 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 80.5 m -66.25 -34.97 79.22 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 177.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 55.3 ttm-85 -58.06 -38.01 75.5 Favored 'General case' 0 N--CA 1.479 0.984 0 O-C-N 120.877 -1.14 . . . . 0.0 111.985 173.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 21.2 p -63.01 -17.51 62.28 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 176.002 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 mt -102.39 -10.68 19.24 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.773 1.229 . . . . 0.0 112.603 176.208 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 106.32 20.0 9.5 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 125.755 1.645 . . . . 0.0 116.399 176.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -149.49 -173.19 4.33 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 119.465 1.633 . . . . 0.0 113.169 -177.115 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 26.2 tp -98.25 157.93 15.87 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.256 1.422 . . . . 0.0 111.732 -174.232 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -116.93 147.98 18.88 Favored Glycine 0 N--CA 1.471 1.032 0 N-CA-C 115.251 0.861 . . . . 0.0 115.251 -178.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -136.43 153.3 51.11 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 128.168 2.587 . . . . 0.0 110.854 171.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 50.5 m -98.67 115.14 28.03 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.638 1.175 . . . . 0.0 109.566 171.028 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.6 mm -127.77 119.87 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 125.725 1.61 . . . . 0.0 108.965 -176.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.22 40.88 92.42 Favored Glycine 0 CA--C 1.533 1.194 0 C-N-CA 123.631 0.634 . . . . 0.0 113.113 -173.059 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 49.32 30.87 3.42 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 127.41 2.284 . . . . 0.0 115.52 -170.336 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -128.09 151.78 48.78 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.796 1.638 . . . . 0.0 110.144 171.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 53.4 t -75.52 137.49 40.91 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.468 -0.77 . . . . 0.0 111.136 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -147.92 130.44 15.83 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 127.291 2.237 . . . . 0.0 109.057 -173.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 13.2 m -107.48 146.58 31.59 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 122.581 1.182 . . . . 0.0 113.755 -171.27 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.7 m -138.5 156.94 73.07 Favored Pre-proline 0 N--CA 1.476 0.862 0 C-N-CA 126.703 2.001 . . . . 0.0 111.733 -172.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -64.91 144.49 83.08 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.677 2.251 . . . . 0.0 111.008 169.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 52.3 m-85 . . . . . 0 C--O 1.256 1.434 0 C-N-CA 125.288 1.435 . . . . 0.0 113.177 -178.649 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.108 0 CA-C-O 121.03 0.239 . . . . 0.0 112.614 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 78.2 p -142.56 2.79 1.44 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.666 1.987 . . . . 0.0 114.642 -171.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 57.03 64.14 1.72 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.968 1.707 . . . . 0.0 112.375 -173.293 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.8 t80 59.6 110.83 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 127.393 2.277 . . . . 0.0 113.264 -165.478 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 29.6 t -57.15 134.34 55.79 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.315 1.446 . . . . 0.0 111.748 -175.018 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 62.8 t-20 -86.52 109.82 19.36 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 124.171 0.988 . . . . 0.0 109.997 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.8 tp -57.89 -34.96 70.37 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-O 117.763 -1.113 . . . . 0.0 112.74 176.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.88 -38.12 89.92 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 120.439 1.472 . . . . 0.0 112.675 177.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.9 ttm105 -78.84 -28.64 44.34 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 120.88 -1.138 . . . . 0.0 113.058 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 32.5 t -73.11 -41.62 63.83 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 125.372 1.469 . . . . 0.0 109.995 172.227 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -57.87 -46.2 85.21 Favored 'General case' 0 C--O 1.221 -0.409 0 C-N-CA 124.922 1.289 . . . . 0.0 110.0 174.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 39.0 tp -62.51 -50.72 70.26 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.232 1.013 . . . . 0.0 112.041 173.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 72.8 m -56.82 -37.87 71.81 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.378 1.071 . . . . 0.0 112.359 -179.064 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 68.8 m -85.12 -37.42 20.26 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 112.994 0.738 . . . . 0.0 112.994 178.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 28.9 ttm105 -64.55 -28.82 69.9 Favored 'General case' 0 N--CA 1.479 1.022 0 O-C-N 120.978 -1.076 . . . . 0.0 112.543 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.3 m -62.08 -24.62 67.22 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 170.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mt -96.31 -9.66 29.65 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.373 0.988 . . . . 0.0 112.299 176.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 101.19 20.42 13.85 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 125.391 1.472 . . . . 0.0 115.77 176.1 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -138.16 -173.25 3.47 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.816 1.646 . . . . 0.0 111.679 176.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 79.2 mt -103.93 161.77 13.69 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.334 1.053 . . . . 0.0 112.801 -170.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -96.2 151.97 20.09 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 124.348 0.975 . . . . 0.0 114.037 179.144 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.1 tptt -143.1 124.0 14.31 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 126.99 2.116 . . . . 0.0 110.371 173.437 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.6 m -100.02 122.03 42.28 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 123.555 0.742 . . . . 0.0 110.003 176.124 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.4 mp -115.58 99.66 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 176.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.48 -94.61 0.03 OUTLIER Glycine 0 CA--C 1.531 1.078 0 C-N-CA 125.84 1.686 . . . . 0.0 113.624 -176.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -104.16 -3.87 23.86 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.11 1.364 . . . . 0.0 114.475 -173.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -139.6 152.34 46.74 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 120.459 1.481 . . . . 0.0 113.602 -175.55 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 14.5 t -92.66 135.85 33.74 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.989 2.115 . . . . 0.0 112.703 -179.492 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -122.33 156.83 33.08 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 128.835 2.854 . . . . 0.0 109.23 171.297 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 28.8 m -112.14 141.37 45.91 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 118.895 0.771 . . . . 0.0 112.644 173.498 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.2 m -129.82 151.12 77.62 Favored Pre-proline 0 N--CA 1.471 0.622 0 C-N-CA 126.603 1.961 . . . . 0.0 112.245 -171.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -72.87 158.76 49.55 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.756 2.971 . . . . 0.0 113.696 -178.083 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 . . . . . 0 C--O 1.253 1.276 0 C-N-CA 125.787 1.635 . . . . 0.0 112.464 171.013 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.008 0 N-CA-C 111.181 -0.768 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.3 p -67.72 -13.71 62.34 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.588 1.155 . . . . 0.0 113.356 165.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -125.98 165.43 18.8 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.11 1.764 . . . . 0.0 110.479 164.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -144.16 125.74 14.99 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 127.721 2.409 . . . . 0.0 109.936 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 45.6 t -113.07 150.82 31.52 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.645 1.978 . . . . 0.0 114.754 -165.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -137.33 114.26 10.6 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.989 1.316 . . . . 0.0 111.111 168.167 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 60.8 tp -60.09 -38.32 82.57 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 117.75 -1.119 . . . . 0.0 112.94 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.34 -34.66 78.49 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 120.761 1.619 . . . . 0.0 113.319 179.169 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 48.2 ttp180 -69.15 -39.35 78.85 Favored 'General case' 0 C--N 1.343 0.293 0 C-N-CA 125.564 1.545 . . . . 0.0 111.593 171.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 24.5 t -70.9 -41.59 71.07 Favored 'General case' 0 C--O 1.22 -0.456 0 C-N-CA 125.21 1.404 . . . . 0.0 110.767 178.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -60.0 -50.65 72.92 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.787 1.235 . . . . 0.0 109.658 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 37.0 tp -62.52 -40.9 98.24 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.064 1.346 . . . . 0.0 112.696 176.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 71.0 m -62.29 -47.09 85.83 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.915 0.886 . . . . 0.0 111.127 174.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.0 m -72.46 -28.26 62.82 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 178.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.65 -37.23 78.15 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.636 -1.29 . . . . 0.0 113.474 177.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 95.1 p -77.03 -2.75 35.6 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.32 1.23 . . . . 0.0 114.32 -178.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -110.25 -1.52 17.26 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.47 1.508 . . . . 0.0 112.32 167.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.48 31.92 12.64 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 125.501 1.525 . . . . 0.0 115.706 175.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -147.25 -169.97 3.44 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-N 119.796 1.798 . . . . 0.0 114.529 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.0 tp -100.09 148.84 24.12 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.465 1.906 . . . . 0.0 111.538 -168.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -93.58 142.91 16.22 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 124.2 0.905 . . . . 0.0 113.784 176.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.0 tptt -132.96 143.35 49.4 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 127.735 2.414 . . . . 0.0 111.442 172.393 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 26.4 t -105.38 113.48 27.09 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 125.472 1.509 . . . . 0.0 109.795 172.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 60.8 mt -135.83 121.7 30.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 124.472 1.109 . . . . 0.0 108.326 -174.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.58 35.47 62.11 Favored Glycine 0 CA--C 1.535 1.31 0 O-C-N 122.104 -0.372 . . . . 0.0 113.508 -177.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.257 42.9 mt-10 58.45 20.83 7.82 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 126.499 1.92 . . . . 0.0 115.691 -177.515 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -117.41 155.02 30.35 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.899 1.279 . . . . 0.0 111.732 162.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 36.6 t -77.57 135.3 38.16 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.087 0.955 . . . . 0.0 111.357 175.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.9 tptp -140.61 128.81 22.29 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 126.029 1.731 . . . . 0.0 108.802 175.09 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 16.5 m -86.45 146.4 26.44 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.843 0.83 . . . . 0.0 112.245 179.231 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.9 m -140.83 161.46 53.98 Favored Pre-proline 0 N--CA 1.473 0.677 0 C-N-CA 127.064 2.145 . . . . 0.0 110.92 -170.224 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.31 153.85 76.32 Favored 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 122.522 2.148 . . . . 0.0 113.866 174.067 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 . . . . . 0 C--O 1.258 1.504 0 C-N-CA 125.746 1.618 . . . . 0.0 111.951 162.43 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.109 0 CA-C-O 119.375 -0.68 . . . . 0.0 113.28 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 84.5 p -151.05 3.31 0.45 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 167.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -139.86 173.29 11.68 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.717 1.607 . . . . 0.0 112.268 -177.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -138.07 85.9 2.13 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.743 1.217 . . . . 0.0 112.245 -167.462 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 51.1 t -73.07 149.48 43.11 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 124.968 1.307 . . . . 0.0 113.414 -177.085 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -121.36 120.18 34.28 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.761 1.624 . . . . 0.0 111.897 179.003 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 55.8 tp -65.02 -39.76 93.87 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 117.736 -1.126 . . . . 0.0 112.948 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.64 -41.06 96.4 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 120.598 1.544 . . . . 0.0 112.28 179.256 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 25.7 ttm180 -67.01 -36.45 82.18 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 126.206 1.803 . . . . 0.0 112.341 175.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 19.8 t -76.15 -38.97 56.06 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 124.776 1.23 . . . . 0.0 111.084 177.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -60.39 -45.17 94.53 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.847 0.859 . . . . 0.0 109.921 173.442 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -60.49 -47.4 86.29 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.253 1.421 . . . . 0.0 111.433 173.334 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.5 m -63.42 -36.87 85.18 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.221 1.008 . . . . 0.0 112.787 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 84.1 m -85.41 -35.51 21.26 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 28.2 ttm105 -69.93 -24.26 63.34 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 120.561 -1.337 . . . . 0.0 112.014 175.013 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 65.6 m -62.44 -15.8 51.49 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 164.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 12.0 mt -101.85 -32.81 10.06 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.903 1.228 . . . . 0.0 111.546 173.045 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.6 -4.28 4.0 Favored Glycine 0 CA--C 1.536 1.362 0 C-N-CA 125.19 1.376 . . . . 0.0 115.389 174.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.504 ' H ' HD23 ' A' ' 19' ' ' LEU . 2.4 pt? -119.49 -163.16 0.96 Allowed 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.144 2.178 . . . . 0.0 112.036 -173.697 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.4 mp -108.81 163.36 13.34 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.633 1.573 . . . . 0.0 111.499 -175.308 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -113.35 152.04 18.12 Favored Glycine 0 CA--C 1.536 1.38 0 C-N-CA 125.304 1.43 . . . . 0.0 114.97 -178.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 49.8 mmtt -142.22 152.78 43.43 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 128.752 2.821 . . . . 0.0 111.927 173.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 31.8 m -97.13 108.06 20.71 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.181 1.393 . . . . 0.0 110.421 170.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 49.4 mt -131.76 126.07 56.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 125.986 1.714 . . . . 0.0 109.272 -173.057 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 63.25 25.35 68.24 Favored Glycine 0 CA--C 1.54 1.626 0 C-N-CA 123.831 0.729 . . . . 0.0 114.288 -174.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 61.55 16.46 7.66 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 127.308 2.243 . . . . 0.0 115.098 -167.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -112.7 160.02 18.34 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.273 1.429 . . . . 0.0 111.753 169.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 40.8 t -72.22 136.57 46.42 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.405 -0.809 . . . . 0.0 111.38 167.004 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.2 tttt -141.68 141.34 33.34 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 126.666 1.986 . . . . 0.0 110.017 173.406 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.7 m -100.02 149.95 22.94 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.852 -0.53 . . . . 0.0 112.408 -177.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.4 m -138.29 147.07 54.16 Favored Pre-proline 0 N--CA 1.476 0.851 0 C-N-CA 125.29 1.436 . . . . 0.0 113.272 -179.336 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -76.1 161.01 36.04 Favored 'Trans proline' 0 CA--C 1.538 0.689 0 C-N-CA 124.632 3.554 . . . . 0.0 112.917 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 18.2 p90 . . . . . 0 C--O 1.25 1.128 0 C-N-CA 125.683 1.593 . . . . 0.0 113.628 179.947 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.231 0 N-CA-C 111.458 -0.657 . . . . 0.0 111.458 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 97.5 p -140.89 24.61 2.18 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 115.76 1.763 . . . . 0.0 115.76 -166.205 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.44 69.76 0.67 Allowed 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.952 2.101 . . . . 0.0 113.522 -173.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 80.3 t80 61.44 131.78 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 127.822 2.449 . . . . 0.0 114.821 -170.36 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 46.7 t -91.23 121.91 33.39 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.705 1.202 . . . . 0.0 110.466 173.548 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 53.6 t-20 -100.38 112.21 24.54 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.895 0.878 . . . . 0.0 109.444 178.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 33.3 tp -61.18 -30.72 70.58 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 117.92 -1.038 . . . . 0.0 112.624 -177.822 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.87 -51.59 68.65 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 120.127 1.33 . . . . 0.0 112.053 170.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -58.92 -41.64 87.77 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 125.915 1.686 . . . . 0.0 111.909 178.224 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.2 t -70.8 -48.3 54.93 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.033 1.733 . . . . 0.0 111.701 178.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.65 -44.44 85.67 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.402 1.081 . . . . 0.0 111.79 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -78.81 -29.43 44.81 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.211 1.404 . . . . 0.0 113.26 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.9 m -74.86 -40.02 61.22 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 118.769 0.713 . . . . 0.0 112.228 173.211 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 84.1 m -66.96 -32.72 74.15 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 118.032 0.378 . . . . 0.0 111.397 169.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -54.0 -38.77 65.45 Favored 'General case' 0 N--CA 1.48 1.026 0 O-C-N 121.016 -1.053 . . . . 0.0 112.897 172.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 73.1 m -72.76 -14.02 61.45 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 115.192 1.553 . . . . 0.0 115.192 -178.263 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.1 mt -95.75 -13.97 23.73 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.462 0.705 . . . . 0.0 111.441 167.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.97 30.67 5.96 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 126.486 1.993 . . . . 0.0 115.065 177.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -142.73 -163.47 1.63 Allowed 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 119.808 1.804 . . . . 0.0 113.025 176.469 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.2 mp -108.36 164.64 12.15 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.544 1.938 . . . . 0.0 111.58 -177.345 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -119.8 154.95 16.28 Favored Glycine 0 CA--C 1.538 1.478 0 C-N-CA 124.835 1.207 . . . . 0.0 115.126 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -135.78 152.82 51.5 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 128.257 2.623 . . . . 0.0 111.249 168.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.7 m -114.89 106.71 14.49 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.156 1.382 . . . . 0.0 112.223 176.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.716 HG22 ' H ' ' A' ' 25' ' ' GLY . 28.0 mm -87.61 -168.5 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 127.179 2.192 . . . . 0.0 108.486 174.051 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.716 ' H ' HG22 ' A' ' 24' ' ' ILE . . . -57.12 95.68 0.05 OUTLIER Glycine 0 CA--C 1.53 0.972 0 C-N-CA 125.11 1.338 . . . . 0.0 112.768 179.135 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 46.07 30.91 1.02 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 127.6 2.36 . . . . 0.0 114.986 -171.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -140.32 133.8 30.04 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.682 1.193 . . . . 0.0 113.934 -178.304 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 9.6 t -87.62 124.54 33.64 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 125.814 1.646 . . . . 0.0 110.902 175.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -119.26 147.97 43.67 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.204 1.802 . . . . 0.0 109.281 174.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 19.4 m -106.03 146.48 30.06 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 118.773 0.715 . . . . 0.0 111.533 174.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.6 m -133.51 153.11 80.19 Favored Pre-proline 0 N--CA 1.477 0.914 0 C-N-CA 125.786 1.634 . . . . 0.0 113.916 -169.118 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -66.87 146.0 76.51 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 124.122 3.214 . . . . 0.0 112.537 173.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 20.2 p90 . . . . . 0 C--O 1.255 1.372 0 C-N-CA 126.622 1.969 . . . . 0.0 112.707 -169.918 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.022 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 62.1 p -154.95 14.88 0.41 Allowed 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.846 1.258 . . . . 0.0 114.374 -178.087 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.5 10.69 0.76 Allowed 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 116.79 2.145 . . . . 0.0 116.79 176.108 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 49.75 128.64 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 129.991 3.316 . . . . 0.0 119.084 157.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 7.4 t -71.83 104.48 3.46 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 120.961 -1.087 . . . . 0.0 113.204 -177.597 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -155.22 116.13 3.92 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.264 1.425 . . . . 0.0 110.534 164.094 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 59.1 tp -60.38 -41.8 94.53 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 117.625 -1.178 . . . . 0.0 112.402 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.91 -49.73 71.5 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 120.098 1.317 . . . . 0.0 112.164 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.3 ttp-105 -59.94 -40.57 89.37 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 119.329 0.968 . . . . 0.0 112.338 176.522 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 7.2 t -69.96 -45.91 66.4 Favored 'General case' 0 C--O 1.222 -0.363 0 C-N-CA 125.176 1.39 . . . . 0.0 110.532 -179.185 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.42 ' CD ' HH12 ' A' ' 15' ' ' ARG . 4.0 mm-40 -57.08 -49.11 76.89 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 119.098 0.863 . . . . 0.0 111.591 174.676 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 87.3 mt -62.4 -41.44 98.66 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.378 1.071 . . . . 0.0 112.452 177.387 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.9 m -68.13 -42.63 79.91 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.153 0.981 . . . . 0.0 112.2 178.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 61.6 m -72.7 -28.63 62.79 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 178.146 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.42 HH12 ' CD ' ' A' ' 11' ' ' GLU . 0.0 OUTLIER -51.38 -43.91 62.01 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.577 1.151 . . . . 0.0 112.453 173.326 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.2 m -69.67 -8.34 46.83 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.36 1.464 . . . . 0.0 114.521 -177.51 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 mt -115.44 -0.49 13.1 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.203 1.401 . . . . 0.0 111.834 178.353 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.42 25.47 21.07 Favored Glycine 0 CA--C 1.535 1.296 0 N-CA-C 116.313 1.285 . . . . 0.0 116.313 173.517 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -148.45 -173.8 4.43 Favored 'General case' 0 CA--C 1.553 1.062 0 CA-C-N 119.197 1.498 . . . . 0.0 114.043 -177.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 89.5 mt -92.85 162.5 14.07 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.948 1.699 . . . . 0.0 111.778 -178.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -123.47 144.96 15.89 Favored Glycine 0 CA--C 1.533 1.214 0 C-N-CA 124.945 1.26 . . . . 0.0 113.935 177.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.93 158.01 43.61 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 125.195 1.398 . . . . 0.0 112.372 170.72 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 18.5 t -89.62 137.91 31.93 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.281 -0.887 . . . . 0.0 110.843 171.755 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 56.3 mt -111.51 99.8 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 169.102 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.06 -73.46 0.18 Allowed Glycine 0 CA--C 1.531 1.079 0 C-N-CA 126.366 1.936 . . . . 0.0 114.289 178.323 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -138.17 13.95 2.83 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 127.05 2.14 . . . . 0.0 113.587 -173.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -150.52 146.38 26.56 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 120.2 -1.562 . . . . 0.0 112.727 -170.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 10.3 t -78.31 135.78 37.58 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.077 0.951 . . . . 0.0 111.534 174.487 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -138.56 146.88 42.38 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.469 1.508 . . . . 0.0 110.192 162.591 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.4 m -88.0 153.96 20.87 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.931 -0.481 . . . . 0.0 111.524 176.3 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.6 m -138.13 151.78 70.52 Favored Pre-proline 0 N--CA 1.473 0.713 0 C-N-CA 126.677 1.991 . . . . 0.0 111.561 -171.263 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -74.36 164.98 32.86 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 124.072 3.181 . . . . 0.0 113.695 -169.187 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 . . . . . 0 C--O 1.258 1.524 0 C-N-CA 125.12 1.368 . . . . 0.0 113.043 169.556 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.928 0 N-CA-C 110.765 -0.934 . . . . 0.0 110.765 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.1 m -69.19 132.76 47.04 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.531 1.132 . . . . 0.0 112.347 -173.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -129.1 14.04 6.22 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.47 1.656 . . . . 0.0 115.47 -166.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 61.25 148.1 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 127.378 2.271 . . . . 0.0 115.342 -174.209 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.7 t -94.89 156.34 16.39 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.868 1.667 . . . . 0.0 111.568 172.29 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -131.86 124.19 29.06 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.264 1.426 . . . . 0.0 108.673 167.365 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 29.6 tp -61.46 -41.15 96.79 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 118.3 -0.857 . . . . 0.0 112.139 -173.567 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.41 -37.41 87.18 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-N 119.798 1.181 . . . . 0.0 113.903 176.274 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 54.3 ttp180 -70.28 -39.61 74.8 Favored 'General case' 0 C--N 1.343 0.305 0 C-N-CA 125.304 1.441 . . . . 0.0 112.284 175.309 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 45.0 t -72.44 -38.55 68.29 Favored 'General case' 0 C--O 1.223 -0.341 0 C-N-CA 125.78 1.632 . . . . 0.0 111.151 179.05 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -56.33 -52.29 65.1 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 124.703 1.201 . . . . 0.0 110.595 175.626 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 44.8 mt -69.57 -37.57 77.05 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.604 0.762 . . . . 0.0 112.944 176.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 68.6 m -58.06 -41.05 82.52 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 121.817 -0.552 . . . . 0.0 111.694 171.674 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 83.6 m -75.76 -31.96 59.76 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 173.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.12 -35.59 73.72 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 120.63 -1.294 . . . . 0.0 112.261 172.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.2 t -60.5 -15.77 30.41 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.716 1.607 . . . . 0.0 113.991 173.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.8 mt -110.23 -6.9 14.93 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.297 1.439 . . . . 0.0 112.497 173.791 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.22 23.36 10.53 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 125.623 1.583 . . . . 0.0 116.604 174.216 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -144.82 -173.12 3.98 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 119.091 1.446 . . . . 0.0 113.749 -177.42 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 91.1 mt -92.77 159.3 15.47 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.444 1.498 . . . . 0.0 111.575 -176.431 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -116.06 148.63 18.89 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 124.199 0.904 . . . . 0.0 114.684 -178.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -135.83 150.1 49.29 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 127.918 2.487 . . . . 0.0 111.79 172.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 50.6 m -97.15 107.22 19.7 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 123.526 0.731 . . . . 0.0 109.324 168.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.515 HG22 ' H ' ' A' ' 25' ' ' GLY . 45.6 mm -81.85 -177.26 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 164.612 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.515 ' H ' HG22 ' A' ' 24' ' ' ILE . . . -53.52 101.73 0.09 OUTLIER Glycine 0 CA--C 1.534 1.274 0 O-C-N 120.513 -1.367 . . . . 0.0 112.956 -177.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 61.14 7.67 1.69 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 127.97 2.508 . . . . 0.0 116.185 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -137.15 147.89 46.26 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.883 1.673 . . . . 0.0 113.253 -175.381 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 43.0 t -76.85 141.85 40.47 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.058 1.343 . . . . 0.0 111.699 171.065 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.6 tppt? -144.9 148.89 34.41 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 127.964 2.506 . . . . 0.0 108.732 175.679 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 10.5 m -104.41 156.39 17.97 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.3 m -140.18 151.56 64.99 Favored Pre-proline 0 N--CA 1.472 0.654 0 C-N-CA 126.488 1.915 . . . . 0.0 111.485 -176.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.49 160.13 50.95 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 124.122 3.215 . . . . 0.0 113.315 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 . . . . . 0 C--O 1.255 1.38 0 C-N-CA 126.098 1.759 . . . . 0.0 113.767 172.51 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.02 0 N-CA-C 111.231 -0.747 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.3 p -158.02 -27.22 0.08 Allowed 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 115.836 1.791 . . . . 0.0 115.836 -165.053 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -144.86 -11.95 0.57 Allowed 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 117.126 2.269 . . . . 0.0 117.126 -169.318 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 60.1 t80 55.49 120.32 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 128.246 2.618 . . . . 0.0 115.209 -174.516 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 33.8 t -74.58 124.25 26.32 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.402 1.081 . . . . 0.0 113.133 -173.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -104.57 118.77 37.4 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 161.295 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.4 tp -57.87 -36.89 72.99 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 118.044 -0.979 . . . . 0.0 113.051 -175.436 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.0 -45.3 93.06 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 120.047 1.294 . . . . 0.0 112.646 173.554 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 21.7 ttm180 -65.78 -37.46 86.37 Favored 'General case' 0 C--N 1.346 0.414 0 C-N-CA 125.601 1.561 . . . . 0.0 113.054 175.351 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.6 t -72.44 -43.89 63.16 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 125.669 1.588 . . . . 0.0 110.064 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -59.82 -43.12 94.71 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.836 -0.54 . . . . 0.0 110.81 172.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 63.1 mt -64.72 -40.38 95.24 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.066 0.848 . . . . 0.0 113.157 173.111 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.4 m -68.59 -39.23 81.02 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.002 0.921 . . . . 0.0 111.1 -179.388 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.4 m -73.93 -30.08 62.37 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 171.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -62.63 -33.22 74.57 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.196 -1.565 . . . . 0.0 111.908 170.151 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 44.2 m -66.47 -11.87 54.44 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 170.044 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.1 mt -102.72 -19.49 14.73 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 120.458 1.481 . . . . 0.0 112.318 166.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 103.6 30.77 5.13 Favored Glycine 0 CA--C 1.538 1.474 0 C-N-CA 125.789 1.661 . . . . 0.0 115.376 177.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -150.36 -177.59 6.03 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.774 1.23 . . . . 0.0 113.409 178.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.7 tp -83.34 145.82 28.84 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.629 1.572 . . . . 0.0 111.577 -174.544 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -105.53 144.97 15.86 Favored Glycine 0 N--CA 1.472 1.081 0 C-N-CA 123.735 0.684 . . . . 0.0 113.452 175.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -137.76 151.54 48.27 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.203 1.801 . . . . 0.0 112.401 175.261 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 75.1 m -96.43 118.66 33.42 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 124.67 1.188 . . . . 0.0 109.787 170.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.6 mp -104.48 104.6 17.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 125.538 1.535 . . . . 0.0 107.116 178.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.65 -77.1 0.06 OUTLIER Glycine 0 CA--C 1.53 1.008 0 C-N-CA 125.29 1.424 . . . . 0.0 112.83 -167.194 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -142.64 0.8 1.29 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.724 1.609 . . . . 0.0 114.495 -177.203 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -128.03 150.26 50.01 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 119.593 1.088 . . . . 0.0 113.065 -177.681 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 45.0 t -77.85 134.58 37.93 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.761 1.624 . . . . 0.0 112.964 -175.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -141.62 165.88 26.28 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 127.982 2.513 . . . . 0.0 109.709 165.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.9 m -114.52 153.94 29.12 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 114.442 1.275 . . . . 0.0 114.442 -175.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.3 m -145.92 164.71 23.94 Favored Pre-proline 0 N--CA 1.485 1.309 0 C-N-CA 127.646 2.379 . . . . 0.0 111.665 -177.326 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -66.78 153.25 78.6 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.741 2.294 . . . . 0.0 113.077 172.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 . . . . . 0 C--O 1.25 1.084 0 C-N-CA 126.537 1.935 . . . . 0.0 113.255 177.443 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.949 0 N-CA-C 112.266 -0.334 . . . . 0.0 112.266 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.5 t -148.43 176.83 9.97 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.838 0.855 . . . . 0.0 112.418 179.212 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 51.43 39.47 24.49 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 127.971 2.508 . . . . 0.0 115.424 176.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -139.59 32.38 2.05 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.634 1.174 . . . . 0.0 113.347 -177.451 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -87.9 -140.9 0.11 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 127.465 2.306 . . . . 0.0 113.579 -176.409 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 61.74 120.38 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 130.461 3.504 . . . . 0.0 113.949 -171.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 61.7 tp -49.38 -41.85 40.41 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.597 1.159 . . . . 0.0 111.904 172.273 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.31 -33.62 76.41 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 -176.698 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 60.1 ttt180 -78.62 -43.08 27.16 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 126.546 1.938 . . . . 0.0 111.125 175.158 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 25.1 t -71.07 -41.05 71.2 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 127.353 2.261 . . . . 0.0 112.087 -173.235 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -53.95 -45.28 71.24 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 119.239 0.927 . . . . 0.0 112.773 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.01 -35.24 61.99 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.781 1.232 . . . . 0.0 111.937 -178.079 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 69.2 m -71.72 -35.82 70.3 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.446 0.698 . . . . 0.0 112.755 173.108 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 81.1 m -71.52 -27.75 63.41 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 119.485 1.038 . . . . 0.0 113.145 172.261 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.36 -38.72 66.39 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.323 1.049 . . . . 0.0 113.755 -176.022 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 88.5 p -69.04 -11.85 61.16 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 -175.596 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.1 mt -108.23 1.74 22.27 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.203 1.401 . . . . 0.0 112.1 174.783 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.14 17.83 35.98 Favored Glycine 0 CA--C 1.535 1.283 0 C-N-CA 126.08 1.8 . . . . 0.0 116.372 170.074 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -136.76 -175.05 3.89 Favored 'General case' 0 CA--C 1.551 0.987 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 -171.121 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 70.1 mt -92.83 156.73 16.79 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 126.505 1.922 . . . . 0.0 111.148 -176.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -112.93 150.61 18.41 Favored Glycine 0 N--CA 1.472 1.058 0 C-N-CA 124.247 0.927 . . . . 0.0 114.311 176.415 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -142.76 154.54 44.35 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 127.956 2.502 . . . . 0.0 111.978 170.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -118.83 120.7 38.1 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.144 1.778 . . . . 0.0 111.452 -177.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.5 mp -141.93 128.33 19.2 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 125.627 1.571 . . . . 0.0 109.722 -177.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.94 44.07 94.64 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 124.396 0.998 . . . . 0.0 114.499 170.093 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.264 4.2 mm-40 62.42 20.54 11.95 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 126.535 1.934 . . . . 0.0 115.273 -175.359 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -131.75 142.9 49.9 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.603 -1.31 . . . . 0.0 113.055 173.097 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 10.2 t -76.84 134.39 39.06 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.805 1.242 . . . . 0.0 111.141 165.341 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.1 ttpt -138.83 138.4 37.48 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.641 1.176 . . . . 0.0 110.45 167.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.0 m -96.39 144.49 26.48 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.675 0.79 . . . . 0.0 112.083 -172.025 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.0 m -128.32 151.95 77.25 Favored Pre-proline 0 N--CA 1.473 0.683 0 C-N-CA 126.576 1.95 . . . . 0.0 112.093 -170.44 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.79 151.32 57.2 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.02 2.48 . . . . 0.0 112.625 -176.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 . . . . . 0 C--O 1.251 1.156 0 C-N-CA 124.119 0.967 . . . . 0.0 110.417 165.398 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.15 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.0 p -67.86 -30.27 69.6 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 122.02 -0.694 . . . . 0.0 111.671 170.463 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -122.49 -167.0 1.5 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.738 2.015 . . . . 0.0 109.387 161.037 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 22.0 p90 -139.31 158.91 43.34 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 127.063 2.145 . . . . 0.0 108.988 177.529 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.4 t -70.56 107.18 3.76 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 122.87 1.319 . . . . 0.0 111.715 172.27 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -136.93 113.72 10.37 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 105.876 -1.898 . . . . 0.0 105.876 145.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 51.6 tp -57.53 -37.17 72.6 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.399 -0.81 . . . . 0.0 111.814 -176.523 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.61 -47.84 58.1 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.503 1.047 . . . . 0.0 112.663 -179.352 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.84 -43.31 76.9 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.195 1.398 . . . . 0.0 111.669 176.029 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.7 t -72.81 -50.94 21.03 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 126.959 2.103 . . . . 0.0 110.693 -178.121 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -53.32 -49.63 66.65 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.944 0.898 . . . . 0.0 111.457 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 87.4 mt -74.46 -34.31 63.12 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.476 1.11 . . . . 0.0 113.27 -175.101 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 37.7 m -66.82 -45.96 76.64 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.002 0.521 . . . . 0.0 110.659 170.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 73.0 m -58.96 -36.61 75.11 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 122.816 0.446 . . . . 0.0 111.599 171.214 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -34.43 71.85 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 120.623 -1.298 . . . . 0.0 113.422 175.663 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.8 p -66.11 -15.03 62.74 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 174.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.5 mt -102.59 -9.49 20.09 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.509 1.123 . . . . 0.0 112.023 170.292 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 120.42 -9.81 10.82 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 126.782 2.134 . . . . 0.0 116.354 172.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -125.59 -173.14 2.76 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 115.76 1.763 . . . . 0.0 115.76 -159.225 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 79.3 mt -94.01 161.69 14.19 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.222 1.409 . . . . 0.0 111.856 -175.131 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -118.12 137.6 13.2 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 125.343 1.449 . . . . 0.0 113.116 173.483 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.7 mptt -134.07 134.86 42.82 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 127.21 2.204 . . . . 0.0 110.66 174.768 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 29.1 m -75.08 151.68 38.63 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 121.745 0.783 . . . . 0.0 112.261 175.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 30.3 mt -123.83 75.63 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 126.445 1.898 . . . . 0.0 107.556 174.462 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.15 -96.61 0.14 Allowed Glycine 0 CA--C 1.531 1.07 0 CA-C-N 114.337 -1.301 . . . . 0.0 112.193 -170.722 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -98.5 -0.22 43.79 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.374 1.47 . . . . 0.0 114.578 -179.272 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -111.76 168.13 9.81 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 127.687 2.395 . . . . 0.0 111.071 177.718 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 9.2 t -146.13 138.11 25.08 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 120.704 -1.247 . . . . 0.0 114.231 167.179 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 33.7 mmtm -139.06 163.07 33.37 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 126.235 1.814 . . . . 0.0 110.861 -174.088 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 7.5 m -89.09 156.74 18.64 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -177.164 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.4 m -148.58 152.23 37.64 Favored Pre-proline 0 N--CA 1.466 0.359 0 C-N-CA 126.218 1.807 . . . . 0.0 111.92 -176.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -73.07 165.69 32.06 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.39 2.727 . . . . 0.0 112.273 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 . . . . . 0 C--O 1.249 1.068 0 C-N-CA 126.217 1.807 . . . . 0.0 112.272 -178.931 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.579 0 N-CA-C 110.027 -1.229 . . . . 0.0 110.027 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.4 p -129.01 -20.22 3.48 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.205 1.402 . . . . 0.0 113.638 178.18 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -123.16 -0.42 8.88 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 115.998 1.851 . . . . 0.0 115.998 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 40.93 68.04 0.46 Allowed 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 127.372 2.269 . . . . 0.0 113.102 168.031 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.1 t -65.21 119.14 10.33 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -154.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -107.33 122.58 46.87 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.24 149.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 65.4 tp -64.15 -37.64 88.2 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 117.891 -1.052 . . . . 0.0 112.999 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.39 -46.12 90.06 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 120.208 1.367 . . . . 0.0 111.542 178.209 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -65.85 -39.7 91.0 Favored 'General case' 0 C--N 1.346 0.441 0 C-N-CA 125.076 1.351 . . . . 0.0 112.841 173.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 19.7 t -63.13 -48.26 79.27 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 124.988 1.315 . . . . 0.0 110.124 178.014 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -59.88 -47.52 85.42 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.778 0.831 . . . . 0.0 111.104 175.755 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 51.4 mt -61.1 -44.48 97.29 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.968 0.804 . . . . 0.0 112.555 177.008 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 58.7 m -72.51 -41.03 66.38 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.163 0.985 . . . . 0.0 112.367 -178.224 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 77.0 m -64.33 -39.13 93.29 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.109 0.868 . . . . 0.0 110.992 172.237 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.1 ttm105 -67.02 -28.73 68.47 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.074 -1.016 . . . . 0.0 113.106 178.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 61.8 m -64.3 -11.14 28.93 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.614 1.339 . . . . 0.0 114.614 168.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.13 2.17 16.61 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 125.251 1.42 . . . . 0.0 112.18 170.522 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 90.94 18.37 47.51 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 126.074 1.797 . . . . 0.0 116.161 173.729 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -136.56 178.24 7.22 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 119.119 1.459 . . . . 0.0 114.344 -176.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -94.0 134.06 36.81 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.38 1.872 . . . . 0.0 111.718 -162.375 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -91.83 132.05 11.08 Favored Glycine 0 CA--C 1.532 1.114 0 CA-C-N 118.491 0.587 . . . . 0.0 113.821 179.067 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.5 tppt? -123.9 139.14 54.26 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 126.59 1.956 . . . . 0.0 111.56 176.464 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 7.1 t -105.6 125.63 51.21 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.989 0.915 . . . . 0.0 110.367 175.606 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.0 mt -118.51 82.79 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 125.302 1.441 . . . . 0.0 108.258 -177.016 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.57 -93.82 0.03 OUTLIER Glycine 0 CA--C 1.532 1.152 0 C-N-CA 125.229 1.395 . . . . 0.0 111.798 -167.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -96.49 -10.49 27.29 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.165 1.786 . . . . 0.0 114.819 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -105.0 147.6 27.62 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 120.52 1.509 . . . . 0.0 114.463 -175.146 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.4 t -106.52 121.33 44.08 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 124.817 1.247 . . . . 0.0 110.22 171.373 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -125.87 147.84 49.35 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 126.01 1.724 . . . . 0.0 109.971 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 6.9 m -107.49 143.69 35.5 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 122.792 0.437 . . . . 0.0 111.915 173.2 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.6 m -135.21 149.05 68.91 Favored Pre-proline 0 N--CA 1.474 0.769 0 C-N-CA 125.18 1.392 . . . . 0.0 112.603 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -82.84 58.74 6.51 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 124.468 3.446 . . . . 0.0 112.656 -170.792 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 . . . . . 0 C--O 1.252 1.199 0 C-N-CA 127.642 2.377 . . . . 0.0 114.171 -179.44 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.884 0 N-CA-C 110.837 -0.905 . . . . 0.0 110.837 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.5 m -80.25 0.84 30.92 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.545 1.538 . . . . 0.0 114.722 -169.488 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -134.7 11.73 3.71 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 114.071 1.138 . . . . 0.0 114.071 174.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -44.29 107.0 0.08 Allowed 'General case' 0 C--O 1.234 0.273 0 C-N-CA 129.237 3.015 . . . . 0.0 112.754 -176.066 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 50.8 t -62.92 124.22 20.52 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 113.878 -1.51 . . . . 0.0 114.752 -157.696 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -121.46 107.63 12.68 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.153 1.381 . . . . 0.0 107.583 153.817 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 41.8 tp -63.65 -33.21 75.11 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 118.232 -0.889 . . . . 0.0 112.657 -175.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.27 -44.66 78.77 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 119.52 1.055 . . . . 0.0 112.795 177.746 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -77.49 -29.91 52.79 Favored 'General case' 0 C--N 1.344 0.353 0 C-N-CA 124.148 0.979 . . . . 0.0 113.447 178.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.8 t -68.07 -44.26 76.73 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 124.965 1.306 . . . . 0.0 110.121 170.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -57.54 -47.35 82.24 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.879 0.763 . . . . 0.0 110.931 171.19 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.6 tt -57.32 -46.14 83.51 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.832 0.853 . . . . 0.0 111.239 176.314 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 48.8 m -70.35 -47.63 60.11 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.519 1.127 . . . . 0.0 112.82 -178.402 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 70.7 m -63.4 -42.88 98.8 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 118.639 0.654 . . . . 0.0 111.179 175.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.5 ttm-85 -74.2 -22.07 59.54 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.745 -1.222 . . . . 0.0 112.651 -177.078 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.8 m -72.19 -16.69 61.97 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 167.536 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.1 mt -89.53 -30.17 18.41 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.271 0.941 . . . . 0.0 111.333 163.222 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 128.28 12.88 2.73 Favored Glycine 0 CA--C 1.536 1.372 0 C-N-CA 125.672 1.606 . . . . 0.0 115.744 173.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -135.4 173.57 11.57 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 119.609 1.704 . . . . 0.0 114.595 -172.392 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.8 tp -84.87 135.85 33.9 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.379 1.471 . . . . 0.0 111.544 -167.599 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.58 137.99 15.86 Favored Glycine 0 CA--C 1.538 1.494 0 CA-C-N 118.725 0.693 . . . . 0.0 113.299 170.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.11 128.21 22.3 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.014 1.726 . . . . 0.0 113.878 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 6.7 t -91.63 133.42 35.58 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.265 1.426 . . . . 0.0 111.587 -179.292 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 13.1 mt -138.98 112.97 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.751 1.221 . . . . 0.0 110.396 -175.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.11 -100.76 0.43 Allowed Glycine 0 CA--C 1.53 1.017 0 N-CA-C 110.558 -1.017 . . . . 0.0 110.558 -168.616 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -126.99 7.95 6.69 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 126.671 1.988 . . . . 0.0 113.965 176.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -123.61 150.14 44.49 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.707 1.203 . . . . 0.0 110.258 -178.664 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.1 t -105.44 145.98 30.12 Favored 'General case' 0 CA--C 1.537 0.481 0 O-C-N 121.372 -0.83 . . . . 0.0 112.581 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -122.16 163.42 19.56 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 128.193 2.597 . . . . 0.0 109.839 174.457 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.9 m -106.34 149.18 27.21 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 122.056 -0.403 . . . . 0.0 111.598 163.021 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.2 m -142.4 156.09 64.03 Favored Pre-proline 0 N--CA 1.479 0.995 0 C-N-CA 124.999 1.32 . . . . 0.0 113.714 -172.81 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -84.5 51.55 3.3 Favored 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 124.987 3.791 . . . . 0.0 113.056 -172.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 . . . . . 0 C--O 1.252 1.229 0 C-N-CA 126.577 1.951 . . . . 0.0 113.604 -178.062 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.769 0 N-CA-C 110.348 -1.101 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.5 m 54.41 32.75 17.16 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.788 1.635 . . . . 0.0 115.253 -179.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.75 59.16 2.47 Favored 'General case' 0 CA--C 1.553 1.077 0 O-C-N 120.841 -1.162 . . . . 0.0 113.021 177.606 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 1.2 t80 47.08 86.21 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 128.456 2.703 . . . . 0.0 116.484 167.011 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 9.4 t -63.87 129.43 40.06 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.15 1.38 . . . . 0.0 111.913 165.065 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -175.67 116.95 0.15 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 127.437 2.295 . . . . 0.0 106.697 167.329 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 29.7 tp -59.22 -40.86 87.18 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.754 1.161 . . . . 0.0 112.438 -173.184 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.7 -48.49 81.54 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 119.488 1.04 . . . . 0.0 112.433 178.37 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -60.07 -43.42 95.47 Favored 'General case' 0 C--N 1.346 0.432 0 C-N-CA 125.645 1.578 . . . . 0.0 112.832 172.614 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 7.9 t -77.38 -43.38 32.96 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 124.986 1.314 . . . . 0.0 111.44 -169.58 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -58.72 -44.49 90.43 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.823 1.192 . . . . 0.0 111.162 171.586 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 79.1 mt -64.55 -38.5 91.22 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 175.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 63.0 m -79.1 -32.38 44.6 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.763 1.225 . . . . 0.0 113.116 -179.24 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 58.6 m -73.33 -27.29 61.44 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 119.009 -0.519 . . . . 0.0 111.129 169.141 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -35.79 75.33 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 119.836 1.198 . . . . 0.0 112.944 167.658 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.7 m -63.51 -19.94 65.19 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.222 1.009 . . . . 0.0 113.083 174.632 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 21.0 mt -100.2 -27.24 13.62 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.28 1.432 . . . . 0.0 112.349 172.445 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 105.33 17.97 12.83 Favored Glycine 0 CA--C 1.539 1.59 0 C-N-CA 126.199 1.857 . . . . 0.0 115.911 178.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -134.56 -177.56 4.66 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.382 1.591 . . . . 0.0 113.13 -175.324 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 30.3 tp -91.27 140.83 29.42 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.121 1.768 . . . . 0.0 112.706 -165.896 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -92.14 141.71 15.72 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 124.817 1.199 . . . . 0.0 115.938 -178.035 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.3 tppt? -143.53 173.62 11.48 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 128.054 2.542 . . . . 0.0 112.927 176.382 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 35.8 t -126.2 144.73 50.66 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.526 1.53 . . . . 0.0 110.864 174.736 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 55.6 mt -135.54 118.16 22.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 124.288 1.035 . . . . 0.0 108.348 166.075 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.23 -79.92 0.63 Allowed Glycine 0 N--CA 1.472 1.055 0 C-N-CA 124.327 0.965 . . . . 0.0 114.412 171.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -150.83 18.42 0.79 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 127.833 2.453 . . . . 0.0 112.003 176.019 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -120.45 145.37 47.31 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.429 2.292 . . . . 0.0 112.663 -177.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 2.1 t -83.88 132.36 34.8 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 124.946 1.298 . . . . 0.0 110.06 169.101 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -136.31 131.4 34.3 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.75 1.22 . . . . 0.0 110.319 -177.594 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 6.3 m -99.19 144.27 28.51 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.182 0.593 . . . . 0.0 111.796 177.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.0 m -134.65 155.19 79.72 Favored Pre-proline 0 N--CA 1.474 0.756 0 C-N-CA 125.921 1.689 . . . . 0.0 112.702 -177.676 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -71.38 161.99 43.81 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.719 2.946 . . . . 0.0 112.659 174.246 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 83.7 m-85 . . . . . 0 C--O 1.251 1.143 0 C-N-CA 125.421 1.488 . . . . 0.0 114.065 -176.238 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.166 0 N-CA-C 111.191 -0.764 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.6 p -62.02 -26.21 68.1 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 126.928 2.091 . . . . 0.0 115.594 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -121.26 -16.82 7.84 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -170.385 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 18.4 t80 67.26 130.1 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 128.531 2.732 . . . . 0.0 117.071 167.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.5 t -78.4 93.94 4.8 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 120.633 -1.292 . . . . 0.0 112.977 176.663 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 55.2 t-20 -151.57 111.94 4.15 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.049 1.34 . . . . 0.0 109.544 161.245 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 42.3 tp -52.26 -41.12 62.55 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.071 0.948 . . . . 0.0 112.647 177.368 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.25 90.27 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 118.939 0.79 . . . . 0.0 112.91 -177.25 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 59.7 ttt180 -71.42 -43.21 67.18 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.701 1.6 . . . . 0.0 111.401 174.277 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 19.7 t -68.46 -40.06 81.19 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 126.442 1.897 . . . . 0.0 112.007 -176.005 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -60.05 -44.11 94.9 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.802 0.728 . . . . 0.0 112.299 178.379 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -74.16 -33.98 63.68 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.75 0.82 . . . . 0.0 112.448 177.049 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 28.4 m -65.49 -47.28 76.59 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 121.601 -0.687 . . . . 0.0 111.87 172.634 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.2 m -70.81 -34.54 71.84 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 118.735 0.698 . . . . 0.0 112.594 177.6 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 41.9 ttm180 -54.91 -34.35 63.04 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 121.289 -0.882 . . . . 0.0 111.161 168.229 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.3 m -77.54 0.58 22.4 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 176.498 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.2 mt -115.92 -3.83 12.12 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 125.278 1.431 . . . . 0.0 112.075 165.119 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.43 19.02 31.23 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 125.733 1.635 . . . . 0.0 116.383 175.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -143.78 -172.05 3.66 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.367 1.467 . . . . 0.0 112.89 -179.35 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 20.5 tp -94.25 150.77 19.99 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.461 1.504 . . . . 0.0 111.901 -168.303 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -106.04 142.81 15.65 Favored Glycine 0 CA--C 1.532 1.113 0 O-C-N 121.424 -0.797 . . . . 0.0 114.523 177.252 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -142.64 160.94 39.32 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 128.031 2.532 . . . . 0.0 111.036 169.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 4.7 t -97.44 138.09 35.42 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.762 -0.586 . . . . 0.0 111.387 167.006 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 55.1 mt -126.49 116.04 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 125.358 1.463 . . . . 0.0 108.848 168.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.41 -96.65 0.15 Allowed Glycine 0 CA--C 1.532 1.127 0 C-N-CA 125.064 1.316 . . . . 0.0 112.453 -176.101 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -125.33 18.89 8.23 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 125.956 1.702 . . . . 0.0 113.62 178.386 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -129.61 145.27 51.5 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.295 1.438 . . . . 0.0 112.861 -174.74 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 9.6 t -74.95 128.11 34.79 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.231 0.613 . . . . 0.0 109.84 160.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -130.45 132.7 45.83 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.306 1.442 . . . . 0.0 108.776 174.559 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 22.5 m -92.84 139.7 30.27 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 120.787 0.327 . . . . 0.0 111.687 -177.443 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.7 m -127.34 152.69 76.61 Favored Pre-proline 0 N--CA 1.469 0.517 0 C-N-CA 126.011 1.725 . . . . 0.0 110.984 -168.603 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -63.24 158.93 41.83 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.287 2.658 . . . . 0.0 112.365 -177.158 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 . . . . . 0 C--O 1.253 1.262 0 C-N-CA 124.576 1.151 . . . . 0.0 109.765 159.591 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 . . . . . 0 CA--C 1.536 0.429 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 53.9 tp -58.26 -45.25 88.16 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-O 117.909 -1.043 . . . . 0.0 112.316 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.2 -39.81 79.92 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 120.208 1.367 . . . . 0.0 112.957 175.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 32.5 ttp180 -78.16 -33.94 49.97 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.291 1.437 . . . . 0.0 113.379 -179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 35.6 t -69.19 -40.82 77.82 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 126.062 1.745 . . . . 0.0 109.933 171.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -61.64 -44.72 96.45 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.291 1.037 . . . . 0.0 111.639 175.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 26.8 mt -66.77 -28.72 68.62 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.177 1.391 . . . . 0.0 113.62 173.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 63.1 m -77.93 -47.78 17.83 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.729 1.212 . . . . 0.0 112.085 175.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 68.4 m -67.49 -31.6 71.85 Favored 'General case' 0 CA--C 1.549 0.91 0 O-C-N 121.248 -0.908 . . . . 0.0 111.774 178.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 42.4 ttm-85 -53.64 -32.95 53.5 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.529 1.532 . . . . 0.0 112.964 166.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.0 m -71.46 -16.74 62.38 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 114.301 1.222 . . . . 0.0 114.301 177.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.1 mt -108.27 -11.06 15.28 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.401 1.08 . . . . 0.0 112.459 175.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 98.42 27.19 8.77 Favored Glycine 0 CA--C 1.537 1.407 0 C-N-CA 125.621 1.581 . . . . 0.0 115.635 174.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -145.28 178.64 7.94 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 119.232 1.516 . . . . 0.0 112.725 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.3 tp -86.78 148.57 25.35 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.913 1.285 . . . . 0.0 111.639 -170.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -100.09 143.24 16.28 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 123.915 0.769 . . . . 0.0 114.099 173.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.13 157.4 44.93 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 127.344 2.258 . . . . 0.0 110.474 169.281 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 85.7 m -100.19 133.71 44.18 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.417 -0.802 . . . . 0.0 110.533 171.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 71.6 mt -138.5 125.14 25.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.181 1.393 . . . . 0.0 108.617 177.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.63 33.2 76.21 Favored Glycine 0 CA--C 1.539 1.552 0 O-C-N 121.487 -0.758 . . . . 0.0 114.265 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 60.72 21.11 11.13 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 127.043 2.137 . . . . 0.0 114.907 -172.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -120.72 152.5 38.19 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.156 1.783 . . . . 0.0 110.953 173.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 33.2 t -76.75 131.02 38.5 Favored 'General case' 0 C--O 1.241 0.657 0 O-C-N 121.593 -0.692 . . . . 0.0 110.525 176.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 42.9 tttt -139.35 127.61 22.67 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.729 1.212 . . . . 0.0 109.974 175.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 12.5 m -89.79 151.79 21.62 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.606 -177.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.4 m -141.05 150.55 59.47 Favored Pre-proline 0 N--CA 1.474 0.737 0 C-N-CA 124.883 1.273 . . . . 0.0 113.112 -175.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -79.19 65.89 8.82 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 124.66 3.574 . . . . 0.0 112.845 -175.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 . . . . . 0 C--O 1.253 1.261 0 C-N-CA 128.404 2.682 . . . . 0.0 114.159 -179.932 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.496 ' N ' ' HG ' ' A' ' 23' ' ' CYS . 8.8 t-20 . . . . . 0 CA--C 1.532 0.253 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 44.4 tp -53.91 -40.53 66.76 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 119.275 0.943 . . . . 0.0 112.001 167.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.29 -42.07 84.35 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.703 1.138 . . . . 0.0 112.981 177.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 31.8 mtp180 -69.13 -36.25 77.27 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.658 1.183 . . . . 0.0 112.386 177.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 16.0 t -78.0 -36.38 48.87 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 125.694 1.598 . . . . 0.0 110.854 178.122 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -55.09 -47.61 74.7 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.58 0.752 . . . . 0.0 111.258 167.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 53.5 mt -63.14 -50.73 69.27 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.222 0.609 . . . . 0.0 111.884 174.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 44.4 m -64.02 -43.51 95.37 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -176.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 78.6 m -65.44 -35.17 80.12 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.189 0.904 . . . . 0.0 112.631 173.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 26.4 ttm105 -69.77 -19.59 63.51 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 120.994 -1.066 . . . . 0.0 113.046 178.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.2 p -62.92 -31.1 72.1 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 118.569 0.622 . . . . 0.0 112.511 166.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 mt -91.31 -6.04 53.73 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.531 1.132 . . . . 0.0 112.555 173.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.24 12.46 39.07 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 126.623 2.059 . . . . 0.0 115.916 174.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -134.79 -177.71 4.75 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 120.08 1.94 . . . . 0.0 113.473 -175.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 80.6 mt -94.14 164.03 13.22 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.6 1.16 . . . . 0.0 111.894 -169.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -117.3 146.54 18.78 Favored Glycine 0 N--CA 1.474 1.225 0 N-CA-C 116.119 1.208 . . . . 0.0 116.119 -171.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 57.4 mmtt -133.9 134.38 42.6 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 127.348 2.259 . . . . 0.0 111.664 165.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.496 ' HG ' ' N ' ' A' ' 6' ' ' ASN . 53.6 t -114.0 109.53 18.61 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.916 1.286 . . . . 0.0 109.925 -177.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 36.9 mm -140.14 127.06 23.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 124.475 1.11 . . . . 0.0 109.723 -167.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.29 29.72 75.8 Favored Glycine 0 CA--C 1.536 1.371 0 CA-C-O 119.379 -0.678 . . . . 0.0 114.609 177.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 62.46 29.32 17.11 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.933 1.693 . . . . 0.0 114.484 -175.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -135.41 155.03 51.22 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.569 1.948 . . . . 0.0 109.917 168.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 10.0 t -107.77 135.38 49.29 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.32 1.048 . . . . 0.0 112.321 -175.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 66.1 mmtt -136.83 153.62 50.74 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 127.156 2.182 . . . . 0.0 111.307 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 12.3 m -115.95 149.35 38.89 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 -174.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.3 m -138.6 156.97 72.9 Favored Pre-proline 0 N--CA 1.481 1.087 0 C-N-CA 127.051 2.14 . . . . 0.0 113.07 -170.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -83.44 165.37 14.34 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 124.069 3.179 . . . . 0.0 114.684 -173.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 . . . . . 0 C--O 1.256 1.402 0 C-N-CA 125.53 1.532 . . . . 0.0 112.012 167.595 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 45.3 t30 . . . . . 0 CA--C 1.534 0.348 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 46.7 tp -57.67 -34.44 69.39 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 118.719 -0.658 . . . . 0.0 112.137 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.23 -46.63 87.96 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 118.975 0.807 . . . . 0.0 112.686 176.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 18.7 ttt180 -66.12 -45.02 82.59 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 126.038 1.735 . . . . 0.0 111.994 175.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 49.7 t -65.55 -44.66 86.15 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 125.402 1.481 . . . . 0.0 111.222 -176.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -54.64 -52.02 63.6 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.562 0.745 . . . . 0.0 111.16 176.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 16.6 tp -73.76 -28.25 61.58 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.662 1.185 . . . . 0.0 113.299 -176.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.4 m -73.4 -47.53 41.19 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.678 0.791 . . . . 0.0 110.867 173.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 95.7 m -60.89 -31.55 71.04 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 171.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -52.82 -32.2 42.96 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.355 1.062 . . . . 0.0 113.649 173.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 54.6 p -63.58 -24.27 67.73 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.3 mt -97.71 -8.75 27.99 Favored 'General case' 0 N--CA 1.477 0.903 0 O-C-N 121.047 -1.033 . . . . 0.0 112.22 174.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 111.47 6.6 25.2 Favored Glycine 0 CA--C 1.532 1.156 0 C-N-CA 126.716 2.103 . . . . 0.0 115.586 172.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -130.01 -172.04 2.68 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 119.972 1.886 . . . . 0.0 114.953 -167.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.2 mt -92.9 157.69 16.23 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.306 1.442 . . . . 0.0 111.203 -176.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -110.39 147.96 17.49 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 124.911 1.243 . . . . 0.0 113.941 174.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -134.23 148.68 50.89 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 126.948 2.099 . . . . 0.0 111.184 167.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.6 m -108.93 125.33 51.91 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.019 1.328 . . . . 0.0 111.1 175.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 mp -131.42 113.35 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 124.898 1.279 . . . . 0.0 110.145 177.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.68 -94.35 0.16 Allowed Glycine 0 CA--C 1.529 0.955 0 C-N-CA 124.139 0.876 . . . . 0.0 111.888 -177.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -114.74 -11.04 12.35 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.809 2.043 . . . . 0.0 113.657 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -112.82 139.88 48.08 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.298 1.039 . . . . 0.0 113.138 -164.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 16.8 t -85.75 122.41 29.8 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 125.168 1.387 . . . . 0.0 109.404 164.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -121.5 143.58 49.19 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.524 1.53 . . . . 0.0 109.117 172.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 10.7 m -99.2 149.35 23.17 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -178.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.9 m -140.92 152.26 64.87 Favored Pre-proline 0 N--CA 1.477 0.893 0 C-N-CA 125.032 1.333 . . . . 0.0 113.772 -174.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -70.58 170.28 17.94 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 124.221 3.281 . . . . 0.0 112.978 176.217 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 . . . . . 0 C--O 1.251 1.166 0 C-N-CA 125.015 1.326 . . . . 0.0 112.349 176.115 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 . . . . . 0 N--CA 1.465 0.324 0 CA-C-O 120.682 0.277 . . . . 0.0 110.6 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 36.4 tp -58.17 -35.68 71.93 Favored 'General case' 0 C--O 1.223 -0.326 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 -177.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.43 -45.12 63.49 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 120.327 1.421 . . . . 0.0 111.704 176.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 21.1 ttm180 -63.05 -36.08 82.39 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.364 1.465 . . . . 0.0 112.926 177.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 28.1 t -77.75 -41.27 38.19 Favored 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 126.854 2.062 . . . . 0.0 111.03 176.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -58.77 -48.77 80.07 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.165 0.893 . . . . 0.0 111.023 171.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 75.3 mt -63.36 -37.32 86.82 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.704 0.802 . . . . 0.0 112.467 177.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 62.9 m -65.75 -51.11 61.89 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.329 0.651 . . . . 0.0 111.821 174.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.2 m -69.83 -35.44 74.77 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -179.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 36.1 ttm105 -65.85 -25.02 67.01 Favored 'General case' 0 N--CA 1.481 1.106 0 O-C-N 120.846 -1.159 . . . . 0.0 113.078 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.6 p -67.63 -15.65 63.76 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 169.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -104.95 -4.78 21.69 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 125.649 1.579 . . . . 0.0 112.306 175.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 97.44 17.31 31.73 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 126.511 2.005 . . . . 0.0 116.348 176.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -143.13 177.16 8.57 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 119.439 1.619 . . . . 0.0 113.365 -178.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.8 tp -91.23 145.78 24.38 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.196 0.998 . . . . 0.0 111.602 -169.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -99.77 141.68 15.59 Favored Glycine 0 N--CA 1.473 1.103 0 O-C-N 121.644 -0.66 . . . . 0.0 113.573 178.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -148.2 126.94 12.57 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 126.409 1.884 . . . . 0.0 109.01 -176.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 56.7 m -82.27 133.69 35.25 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.147 -0.971 . . . . 0.0 110.819 -177.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 50.5 mt -125.22 118.57 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 123.815 0.846 . . . . 0.0 109.096 175.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 68.67 -83.39 0.21 Allowed Glycine 0 CA--C 1.524 0.643 0 C-N-CA 125.709 1.623 . . . . 0.0 111.742 -176.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -143.1 3.1 1.35 Allowed 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.075 1.75 . . . . 0.0 112.831 -176.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -133.88 158.38 43.58 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.556 1.542 . . . . 0.0 112.751 -172.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 41.4 t -87.51 130.28 34.77 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.737 1.215 . . . . 0.0 112.479 -175.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -127.66 159.8 33.58 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 127.14 2.176 . . . . 0.0 109.744 172.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 8.3 m -122.59 141.53 51.6 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -176.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.5 m -133.52 157.89 76.92 Favored Pre-proline 0 N--CA 1.475 0.78 0 C-N-CA 126.702 2.001 . . . . 0.0 112.694 -167.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.5 154.73 68.38 Favored 'Trans proline' 0 C--O 1.241 0.643 0 C-N-CA 123.367 2.711 . . . . 0.0 112.454 171.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 . . . . . 0 C--O 1.252 1.225 0 C-N-CA 126.292 1.837 . . . . 0.0 112.528 175.209 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 . . . . . 0 CA--C 1.537 0.473 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.5 tp -62.8 -35.7 80.74 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-O 117.973 -1.013 . . . . 0.0 112.555 -175.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.74 -45.57 82.12 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 120.117 1.326 . . . . 0.0 111.998 173.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -60.41 -44.71 95.45 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 123.926 0.89 . . . . 0.0 111.465 176.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 33.9 t -68.66 -43.69 75.66 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 124.916 1.286 . . . . 0.0 110.946 178.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -53.84 -52.52 60.12 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 124.015 0.926 . . . . 0.0 110.545 176.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 75.7 mt -75.07 -37.64 61.55 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.435 1.094 . . . . 0.0 113.439 -176.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.9 m -60.17 -41.17 92.29 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.0 0.818 . . . . 0.0 111.182 170.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 73.8 m -71.66 -33.11 68.6 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 171.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.55 -35.7 76.67 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 120.74 -1.225 . . . . 0.0 112.382 178.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.6 m -62.48 -6.82 3.69 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 174.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -115.3 -3.57 12.47 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 125.476 1.511 . . . . 0.0 113.391 174.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.26 29.7 8.75 Favored Glycine 0 CA--C 1.541 1.675 0 C-N-CA 125.028 1.299 . . . . 0.0 116.17 175.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -150.89 -173.02 4.36 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.413 1.485 . . . . 0.0 112.026 178.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 11.1 mp -105.05 156.67 17.84 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.599 1.159 . . . . 0.0 111.726 -175.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -112.02 139.98 15.92 Favored Glycine 0 CA--C 1.525 0.675 0 C-N-CA 124.99 1.281 . . . . 0.0 113.155 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -131.12 149.78 52.44 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 126.593 1.957 . . . . 0.0 110.564 177.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 27.4 m -101.28 129.38 47.24 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 124.101 0.96 . . . . 0.0 111.98 -174.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 25.2 mt -128.35 90.74 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 124.908 1.283 . . . . 0.0 109.152 -174.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.76 -73.77 0.25 Allowed Glycine 0 CA--C 1.534 1.272 0 C-N-CA 125.964 1.745 . . . . 0.0 114.452 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -135.18 -2.75 2.5 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.684 1.994 . . . . 0.0 112.752 176.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -108.14 153.94 22.43 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 127.437 2.295 . . . . 0.0 111.32 -173.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 11.7 t -106.05 130.42 53.97 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.469 1.508 . . . . 0.0 110.064 171.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.4 mptt -126.99 148.36 50.1 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.201 1.801 . . . . 0.0 110.418 175.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 10.3 m -110.0 124.95 52.35 Favored 'General case' 0 C--O 1.238 0.48 0 C-N-CA 123.818 0.847 . . . . 0.0 111.742 -178.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.0 m -99.21 144.91 29.11 Favored Pre-proline 0 N--CA 1.471 0.607 0 C-N-CA 126.008 1.723 . . . . 0.0 113.493 -167.349 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -74.99 117.87 5.07 Favored 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 123.091 2.527 . . . . 0.0 115.048 -153.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 . . . . . 0 C--O 1.256 1.43 0 C-N-CA 126.856 2.062 . . . . 0.0 112.554 170.059 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 . . . . . 0 CA--C 1.533 0.311 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.1 tp -67.69 -32.52 73.24 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-O 118.552 -0.737 . . . . 0.0 111.884 -174.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.36 -43.53 98.6 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 119.37 0.986 . . . . 0.0 111.895 174.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 32.7 ttp85 -70.98 -36.1 72.38 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 125.38 1.472 . . . . 0.0 112.803 177.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 37.7 t -73.33 -39.69 65.05 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 126.003 1.721 . . . . 0.0 111.119 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -57.98 -52.1 66.92 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 123.43 0.692 . . . . 0.0 109.867 171.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 76.4 mt -59.31 -41.21 88.51 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 119.275 0.943 . . . . 0.0 112.639 174.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.2 m -64.03 -47.37 80.51 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.861 0.865 . . . . 0.0 112.369 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 93.7 m -73.01 -37.23 67.03 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 177.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 40.8 ttm-85 -70.3 -23.47 62.86 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.696 1.198 . . . . 0.0 112.239 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.6 m -63.3 -17.35 62.44 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.26 1.024 . . . . 0.0 113.672 166.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.07 -0.19 25.02 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 126.195 1.798 . . . . 0.0 112.547 173.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.86 26.86 30.63 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 125.266 1.412 . . . . 0.0 116.169 175.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -144.63 -179.69 6.73 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.651 1.581 . . . . 0.0 113.092 176.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 21.6 tp -88.19 141.49 28.52 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.581 1.552 . . . . 0.0 111.745 -167.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -93.56 141.88 15.74 Favored Glycine 0 CA--C 1.532 1.135 0 O-C-N 121.931 -0.481 . . . . 0.0 113.82 174.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -138.72 151.56 47.25 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.819 2.048 . . . . 0.0 111.758 172.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 33.6 m -103.18 114.26 28.41 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.75 1.22 . . . . 0.0 110.094 174.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 51.5 mt -141.24 107.8 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 124.92 1.288 . . . . 0.0 110.699 -173.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.7 51.28 5.23 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 124.9 1.238 . . . . 0.0 113.282 177.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 79.3 mt-10 57.7 10.43 1.05 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 126.252 1.821 . . . . 0.0 114.655 -171.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -133.7 154.73 50.72 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.859 1.663 . . . . 0.0 112.755 -168.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 40.0 t -83.07 135.86 34.68 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.39 1.076 . . . . 0.0 111.611 175.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 30.7 tptt -142.51 146.88 35.16 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.968 1.707 . . . . 0.0 110.746 176.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.0 m -105.56 144.13 32.75 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.8 m -135.35 156.02 78.23 Favored Pre-proline 0 N--CA 1.474 0.77 0 C-N-CA 126.285 1.834 . . . . 0.0 110.916 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -63.13 155.03 63.72 Favored 'Trans proline' 0 CA--C 1.536 0.58 0 C-N-CA 122.568 2.178 . . . . 0.0 112.245 173.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 . . . . . 0 C--O 1.251 1.149 0 C-N-CA 124.194 0.998 . . . . 0.0 111.561 171.507 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 . . . . . 0 CA--C 1.537 0.473 0 N-CA-C 108.623 -0.881 . . . . 0.0 108.623 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 42.8 tp -61.76 -38.16 86.96 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 117.924 -1.036 . . . . 0.0 113.0 -175.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -69.35 -38.11 77.98 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 120.569 1.532 . . . . 0.0 112.448 176.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.5 tmm_? -61.96 -38.89 90.24 Favored 'General case' 0 C--N 1.344 0.369 0 C-N-CA 124.633 1.173 . . . . 0.0 112.999 172.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 34.4 t -77.76 -38.73 46.24 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 125.313 1.445 . . . . 0.0 111.404 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -62.31 -45.49 93.03 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.518 0.599 . . . . 0.0 110.294 177.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 39.0 tp -62.16 -44.36 96.78 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.722 1.209 . . . . 0.0 112.506 172.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.8 m -60.64 -50.3 74.08 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 122.791 0.437 . . . . 0.0 110.934 178.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 80.5 m -66.25 -34.97 79.22 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 177.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 55.3 ttm-85 -58.06 -38.01 75.5 Favored 'General case' 0 N--CA 1.479 0.984 0 O-C-N 120.877 -1.14 . . . . 0.0 111.985 173.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 21.2 p -63.01 -17.51 62.28 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 176.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 mt -102.39 -10.68 19.24 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.773 1.229 . . . . 0.0 112.603 176.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 106.32 20.0 9.5 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 125.755 1.645 . . . . 0.0 116.399 176.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -149.49 -173.19 4.33 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 119.465 1.633 . . . . 0.0 113.169 -177.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 26.2 tp -98.25 157.93 15.87 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.256 1.422 . . . . 0.0 111.732 -174.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -116.93 147.98 18.88 Favored Glycine 0 N--CA 1.471 1.032 0 N-CA-C 115.251 0.861 . . . . 0.0 115.251 -178.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -136.43 153.3 51.11 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 128.168 2.587 . . . . 0.0 110.854 171.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 50.5 m -98.67 115.14 28.03 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.638 1.175 . . . . 0.0 109.566 171.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.6 mm -127.77 119.87 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 125.725 1.61 . . . . 0.0 108.965 -176.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.22 40.88 92.42 Favored Glycine 0 CA--C 1.533 1.194 0 C-N-CA 123.631 0.634 . . . . 0.0 113.113 -173.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 49.32 30.87 3.42 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 127.41 2.284 . . . . 0.0 115.52 -170.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -128.09 151.78 48.78 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.796 1.638 . . . . 0.0 110.144 171.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 53.4 t -75.52 137.49 40.91 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.468 -0.77 . . . . 0.0 111.136 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -147.92 130.44 15.83 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 127.291 2.237 . . . . 0.0 109.057 -173.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 13.2 m -107.48 146.58 31.59 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 122.581 1.182 . . . . 0.0 113.755 -171.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.7 m -138.5 156.94 73.07 Favored Pre-proline 0 N--CA 1.476 0.862 0 C-N-CA 126.703 2.001 . . . . 0.0 111.733 -172.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -64.91 144.49 83.08 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.677 2.251 . . . . 0.0 111.008 169.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 52.3 m-85 . . . . . 0 C--O 1.256 1.434 0 C-N-CA 125.288 1.435 . . . . 0.0 113.177 -178.649 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 62.8 t-20 . . . . . 0 C--O 1.237 0.413 0 N-CA-C 109.997 -0.371 . . . . 0.0 109.997 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.8 tp -57.89 -34.96 70.37 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-O 117.763 -1.113 . . . . 0.0 112.74 176.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.88 -38.12 89.92 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 120.439 1.472 . . . . 0.0 112.675 177.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.9 ttm105 -78.84 -28.64 44.34 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 120.88 -1.138 . . . . 0.0 113.058 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 32.5 t -73.11 -41.62 63.83 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 125.372 1.469 . . . . 0.0 109.995 172.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -57.87 -46.2 85.21 Favored 'General case' 0 C--O 1.221 -0.409 0 C-N-CA 124.922 1.289 . . . . 0.0 110.0 174.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 39.0 tp -62.51 -50.72 70.26 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.232 1.013 . . . . 0.0 112.041 173.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 72.8 m -56.82 -37.87 71.81 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.378 1.071 . . . . 0.0 112.359 -179.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 68.8 m -85.12 -37.42 20.26 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 112.994 0.738 . . . . 0.0 112.994 178.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 28.9 ttm105 -64.55 -28.82 69.9 Favored 'General case' 0 N--CA 1.479 1.022 0 O-C-N 120.978 -1.076 . . . . 0.0 112.543 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.3 m -62.08 -24.62 67.22 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 170.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mt -96.31 -9.66 29.65 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.373 0.988 . . . . 0.0 112.299 176.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 101.19 20.42 13.85 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 125.391 1.472 . . . . 0.0 115.77 176.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -138.16 -173.25 3.47 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.816 1.646 . . . . 0.0 111.679 176.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 79.2 mt -103.93 161.77 13.69 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.334 1.053 . . . . 0.0 112.801 -170.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -96.2 151.97 20.09 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 124.348 0.975 . . . . 0.0 114.037 179.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.1 tptt -143.1 124.0 14.31 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 126.99 2.116 . . . . 0.0 110.371 173.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.6 m -100.02 122.03 42.28 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 123.555 0.742 . . . . 0.0 110.003 176.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.4 mp -115.58 99.66 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 176.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.48 -94.61 0.03 OUTLIER Glycine 0 CA--C 1.531 1.078 0 C-N-CA 125.84 1.686 . . . . 0.0 113.624 -176.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -104.16 -3.87 23.86 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.11 1.364 . . . . 0.0 114.475 -173.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -139.6 152.34 46.74 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 120.459 1.481 . . . . 0.0 113.602 -175.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 14.5 t -92.66 135.85 33.74 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.989 2.115 . . . . 0.0 112.703 -179.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -122.33 156.83 33.08 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 128.835 2.854 . . . . 0.0 109.23 171.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 28.8 m -112.14 141.37 45.91 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 118.895 0.771 . . . . 0.0 112.644 173.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.2 m -129.82 151.12 77.62 Favored Pre-proline 0 N--CA 1.471 0.622 0 C-N-CA 126.603 1.961 . . . . 0.0 112.245 -171.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -72.87 158.76 49.55 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.756 2.971 . . . . 0.0 113.696 -178.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 . . . . . 0 C--O 1.253 1.276 0 C-N-CA 125.787 1.635 . . . . 0.0 112.464 171.013 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 . . . . . 0 CA--C 1.543 0.697 0 CA-C-O 120.768 0.318 . . . . 0.0 111.111 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 60.8 tp -60.09 -38.32 82.57 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 117.75 -1.119 . . . . 0.0 112.94 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.34 -34.66 78.49 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 120.761 1.619 . . . . 0.0 113.319 179.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 48.2 ttp180 -69.15 -39.35 78.85 Favored 'General case' 0 C--N 1.343 0.293 0 C-N-CA 125.564 1.545 . . . . 0.0 111.593 171.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 24.5 t -70.9 -41.59 71.07 Favored 'General case' 0 C--O 1.22 -0.456 0 C-N-CA 125.21 1.404 . . . . 0.0 110.767 178.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -60.0 -50.65 72.92 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.787 1.235 . . . . 0.0 109.658 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 37.0 tp -62.52 -40.9 98.24 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.064 1.346 . . . . 0.0 112.696 176.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 71.0 m -62.29 -47.09 85.83 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.915 0.886 . . . . 0.0 111.127 174.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.0 m -72.46 -28.26 62.82 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 178.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.65 -37.23 78.15 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.636 -1.29 . . . . 0.0 113.474 177.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 95.1 p -77.03 -2.75 35.6 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.32 1.23 . . . . 0.0 114.32 -178.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -110.25 -1.52 17.26 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.47 1.508 . . . . 0.0 112.32 167.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.48 31.92 12.64 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 125.501 1.525 . . . . 0.0 115.706 175.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -147.25 -169.97 3.44 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-N 119.796 1.798 . . . . 0.0 114.529 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.0 tp -100.09 148.84 24.12 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.465 1.906 . . . . 0.0 111.538 -168.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -93.58 142.91 16.22 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 124.2 0.905 . . . . 0.0 113.784 176.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.0 tptt -132.96 143.35 49.4 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 127.735 2.414 . . . . 0.0 111.442 172.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 26.4 t -105.38 113.48 27.09 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 125.472 1.509 . . . . 0.0 109.795 172.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 60.8 mt -135.83 121.7 30.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 124.472 1.109 . . . . 0.0 108.326 -174.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.58 35.47 62.11 Favored Glycine 0 CA--C 1.535 1.31 0 O-C-N 122.104 -0.372 . . . . 0.0 113.508 -177.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.257 42.9 mt-10 58.45 20.83 7.82 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 126.499 1.92 . . . . 0.0 115.691 -177.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -117.41 155.02 30.35 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.899 1.279 . . . . 0.0 111.732 162.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 36.6 t -77.57 135.3 38.16 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.087 0.955 . . . . 0.0 111.357 175.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.9 tptp -140.61 128.81 22.29 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 126.029 1.731 . . . . 0.0 108.802 175.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 16.5 m -86.45 146.4 26.44 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.843 0.83 . . . . 0.0 112.245 179.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.9 m -140.83 161.46 53.98 Favored Pre-proline 0 N--CA 1.473 0.677 0 C-N-CA 127.064 2.145 . . . . 0.0 110.92 -170.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.31 153.85 76.32 Favored 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 122.522 2.148 . . . . 0.0 113.866 174.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 . . . . . 0 C--O 1.258 1.504 0 C-N-CA 125.746 1.618 . . . . 0.0 111.951 162.43 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 . . . . . 0 CA--C 1.546 0.789 0 CA-C-O 121.046 0.451 . . . . 0.0 111.897 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 55.8 tp -65.02 -39.76 93.87 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 117.736 -1.126 . . . . 0.0 112.948 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.64 -41.06 96.4 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 120.598 1.544 . . . . 0.0 112.28 179.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 25.7 ttm180 -67.01 -36.45 82.18 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 126.206 1.803 . . . . 0.0 112.341 175.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 19.8 t -76.15 -38.97 56.06 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 124.776 1.23 . . . . 0.0 111.084 177.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -60.39 -45.17 94.53 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.847 0.859 . . . . 0.0 109.921 173.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -60.49 -47.4 86.29 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.253 1.421 . . . . 0.0 111.433 173.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.5 m -63.42 -36.87 85.18 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.221 1.008 . . . . 0.0 112.787 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 84.1 m -85.41 -35.51 21.26 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 28.2 ttm105 -69.93 -24.26 63.34 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 120.561 -1.337 . . . . 0.0 112.014 175.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 65.6 m -62.44 -15.8 51.49 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 164.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 12.0 mt -101.85 -32.81 10.06 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.903 1.228 . . . . 0.0 111.546 173.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.6 -4.28 4.0 Favored Glycine 0 CA--C 1.536 1.362 0 C-N-CA 125.19 1.376 . . . . 0.0 115.389 174.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.504 ' H ' HD23 ' A' ' 19' ' ' LEU . 2.4 pt? -119.49 -163.16 0.96 Allowed 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.144 2.178 . . . . 0.0 112.036 -173.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.4 mp -108.81 163.36 13.34 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.633 1.573 . . . . 0.0 111.499 -175.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -113.35 152.04 18.12 Favored Glycine 0 CA--C 1.536 1.38 0 C-N-CA 125.304 1.43 . . . . 0.0 114.97 -178.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 49.8 mmtt -142.22 152.78 43.43 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 128.752 2.821 . . . . 0.0 111.927 173.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 31.8 m -97.13 108.06 20.71 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.181 1.393 . . . . 0.0 110.421 170.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 49.4 mt -131.76 126.07 56.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 125.986 1.714 . . . . 0.0 109.272 -173.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 63.25 25.35 68.24 Favored Glycine 0 CA--C 1.54 1.626 0 C-N-CA 123.831 0.729 . . . . 0.0 114.288 -174.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 61.55 16.46 7.66 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 127.308 2.243 . . . . 0.0 115.098 -167.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -112.7 160.02 18.34 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.273 1.429 . . . . 0.0 111.753 169.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 40.8 t -72.22 136.57 46.42 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.405 -0.809 . . . . 0.0 111.38 167.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.2 tttt -141.68 141.34 33.34 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 126.666 1.986 . . . . 0.0 110.017 173.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.7 m -100.02 149.95 22.94 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.852 -0.53 . . . . 0.0 112.408 -177.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.4 m -138.29 147.07 54.16 Favored Pre-proline 0 N--CA 1.476 0.851 0 C-N-CA 125.29 1.436 . . . . 0.0 113.272 -179.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -76.1 161.01 36.04 Favored 'Trans proline' 0 CA--C 1.538 0.689 0 C-N-CA 124.632 3.554 . . . . 0.0 112.917 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 18.2 p90 . . . . . 0 C--O 1.25 1.128 0 C-N-CA 125.683 1.593 . . . . 0.0 113.628 179.947 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 53.6 t-20 . . . . . 0 CA--C 1.534 0.357 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 33.3 tp -61.18 -30.72 70.58 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 117.92 -1.038 . . . . 0.0 112.624 -177.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.87 -51.59 68.65 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 120.127 1.33 . . . . 0.0 112.053 170.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -58.92 -41.64 87.77 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 125.915 1.686 . . . . 0.0 111.909 178.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.2 t -70.8 -48.3 54.93 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.033 1.733 . . . . 0.0 111.701 178.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.65 -44.44 85.67 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.402 1.081 . . . . 0.0 111.79 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -78.81 -29.43 44.81 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.211 1.404 . . . . 0.0 113.26 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.9 m -74.86 -40.02 61.22 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 118.769 0.713 . . . . 0.0 112.228 173.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 84.1 m -66.96 -32.72 74.15 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 118.032 0.378 . . . . 0.0 111.397 169.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -54.0 -38.77 65.45 Favored 'General case' 0 N--CA 1.48 1.026 0 O-C-N 121.016 -1.053 . . . . 0.0 112.897 172.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 73.1 m -72.76 -14.02 61.45 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 115.192 1.553 . . . . 0.0 115.192 -178.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.1 mt -95.75 -13.97 23.73 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.462 0.705 . . . . 0.0 111.441 167.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.97 30.67 5.96 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 126.486 1.993 . . . . 0.0 115.065 177.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -142.73 -163.47 1.63 Allowed 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 119.808 1.804 . . . . 0.0 113.025 176.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.2 mp -108.36 164.64 12.15 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.544 1.938 . . . . 0.0 111.58 -177.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -119.8 154.95 16.28 Favored Glycine 0 CA--C 1.538 1.478 0 C-N-CA 124.835 1.207 . . . . 0.0 115.126 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -135.78 152.82 51.5 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 128.257 2.623 . . . . 0.0 111.249 168.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.7 m -114.89 106.71 14.49 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.156 1.382 . . . . 0.0 112.223 176.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.716 HG22 ' H ' ' A' ' 25' ' ' GLY . 28.0 mm -87.61 -168.5 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 127.179 2.192 . . . . 0.0 108.486 174.051 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.716 ' H ' HG22 ' A' ' 24' ' ' ILE . . . -57.12 95.68 0.05 OUTLIER Glycine 0 CA--C 1.53 0.972 0 C-N-CA 125.11 1.338 . . . . 0.0 112.768 179.135 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 46.07 30.91 1.02 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 127.6 2.36 . . . . 0.0 114.986 -171.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -140.32 133.8 30.04 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.682 1.193 . . . . 0.0 113.934 -178.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 9.6 t -87.62 124.54 33.64 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 125.814 1.646 . . . . 0.0 110.902 175.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -119.26 147.97 43.67 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.204 1.802 . . . . 0.0 109.281 174.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 19.4 m -106.03 146.48 30.06 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 118.773 0.715 . . . . 0.0 111.533 174.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.6 m -133.51 153.11 80.19 Favored Pre-proline 0 N--CA 1.477 0.914 0 C-N-CA 125.786 1.634 . . . . 0.0 113.916 -169.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -66.87 146.0 76.51 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 124.122 3.214 . . . . 0.0 112.537 173.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 20.2 p90 . . . . . 0 C--O 1.255 1.372 0 C-N-CA 126.622 1.969 . . . . 0.0 112.707 -169.918 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 . . . . . 0 N--CA 1.469 0.486 0 N-CA-C 110.534 -0.173 . . . . 0.0 110.534 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 59.1 tp -60.38 -41.8 94.53 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 117.625 -1.178 . . . . 0.0 112.402 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.91 -49.73 71.5 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 120.098 1.317 . . . . 0.0 112.164 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.3 ttp-105 -59.94 -40.57 89.37 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 119.329 0.968 . . . . 0.0 112.338 176.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 7.2 t -69.96 -45.91 66.4 Favored 'General case' 0 C--O 1.222 -0.363 0 C-N-CA 125.176 1.39 . . . . 0.0 110.532 -179.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.42 ' CD ' HH12 ' A' ' 15' ' ' ARG . 4.0 mm-40 -57.08 -49.11 76.89 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 119.098 0.863 . . . . 0.0 111.591 174.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 87.3 mt -62.4 -41.44 98.66 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.378 1.071 . . . . 0.0 112.452 177.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.9 m -68.13 -42.63 79.91 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.153 0.981 . . . . 0.0 112.2 178.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 61.6 m -72.7 -28.63 62.79 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 178.146 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.42 HH12 ' CD ' ' A' ' 11' ' ' GLU . 0.0 OUTLIER -51.38 -43.91 62.01 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.577 1.151 . . . . 0.0 112.453 173.326 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.2 m -69.67 -8.34 46.83 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.36 1.464 . . . . 0.0 114.521 -177.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 mt -115.44 -0.49 13.1 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.203 1.401 . . . . 0.0 111.834 178.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.42 25.47 21.07 Favored Glycine 0 CA--C 1.535 1.296 0 N-CA-C 116.313 1.285 . . . . 0.0 116.313 173.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -148.45 -173.8 4.43 Favored 'General case' 0 CA--C 1.553 1.062 0 CA-C-N 119.197 1.498 . . . . 0.0 114.043 -177.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 89.5 mt -92.85 162.5 14.07 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.948 1.699 . . . . 0.0 111.778 -178.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -123.47 144.96 15.89 Favored Glycine 0 CA--C 1.533 1.214 0 C-N-CA 124.945 1.26 . . . . 0.0 113.935 177.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.93 158.01 43.61 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 125.195 1.398 . . . . 0.0 112.372 170.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 18.5 t -89.62 137.91 31.93 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.281 -0.887 . . . . 0.0 110.843 171.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 56.3 mt -111.51 99.8 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 169.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.06 -73.46 0.18 Allowed Glycine 0 CA--C 1.531 1.079 0 C-N-CA 126.366 1.936 . . . . 0.0 114.289 178.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -138.17 13.95 2.83 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 127.05 2.14 . . . . 0.0 113.587 -173.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -150.52 146.38 26.56 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 120.2 -1.562 . . . . 0.0 112.727 -170.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 10.3 t -78.31 135.78 37.58 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.077 0.951 . . . . 0.0 111.534 174.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -138.56 146.88 42.38 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.469 1.508 . . . . 0.0 110.192 162.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.4 m -88.0 153.96 20.87 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.931 -0.481 . . . . 0.0 111.524 176.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.6 m -138.13 151.78 70.52 Favored Pre-proline 0 N--CA 1.473 0.713 0 C-N-CA 126.677 1.991 . . . . 0.0 111.561 -171.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -74.36 164.98 32.86 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 124.072 3.181 . . . . 0.0 113.695 -169.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 . . . . . 0 C--O 1.258 1.524 0 C-N-CA 125.12 1.368 . . . . 0.0 113.043 169.556 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 . . . . . 0 N--CA 1.469 0.509 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 29.6 tp -61.46 -41.15 96.79 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 118.3 -0.857 . . . . 0.0 112.139 -173.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.41 -37.41 87.18 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-N 119.798 1.181 . . . . 0.0 113.903 176.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 54.3 ttp180 -70.28 -39.61 74.8 Favored 'General case' 0 C--N 1.343 0.305 0 C-N-CA 125.304 1.441 . . . . 0.0 112.284 175.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 45.0 t -72.44 -38.55 68.29 Favored 'General case' 0 C--O 1.223 -0.341 0 C-N-CA 125.78 1.632 . . . . 0.0 111.151 179.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -56.33 -52.29 65.1 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 124.703 1.201 . . . . 0.0 110.595 175.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 44.8 mt -69.57 -37.57 77.05 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.604 0.762 . . . . 0.0 112.944 176.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 68.6 m -58.06 -41.05 82.52 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 121.817 -0.552 . . . . 0.0 111.694 171.674 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 83.6 m -75.76 -31.96 59.76 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 173.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.12 -35.59 73.72 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 120.63 -1.294 . . . . 0.0 112.261 172.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.2 t -60.5 -15.77 30.41 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.716 1.607 . . . . 0.0 113.991 173.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.8 mt -110.23 -6.9 14.93 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.297 1.439 . . . . 0.0 112.497 173.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.22 23.36 10.53 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 125.623 1.583 . . . . 0.0 116.604 174.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -144.82 -173.12 3.98 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 119.091 1.446 . . . . 0.0 113.749 -177.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 91.1 mt -92.77 159.3 15.47 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.444 1.498 . . . . 0.0 111.575 -176.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -116.06 148.63 18.89 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 124.199 0.904 . . . . 0.0 114.684 -178.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -135.83 150.1 49.29 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 127.918 2.487 . . . . 0.0 111.79 172.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 50.6 m -97.15 107.22 19.7 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 123.526 0.731 . . . . 0.0 109.324 168.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.515 HG22 ' H ' ' A' ' 25' ' ' GLY . 45.6 mm -81.85 -177.26 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 164.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.515 ' H ' HG22 ' A' ' 24' ' ' ILE . . . -53.52 101.73 0.09 OUTLIER Glycine 0 CA--C 1.534 1.274 0 O-C-N 120.513 -1.367 . . . . 0.0 112.956 -177.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 61.14 7.67 1.69 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 127.97 2.508 . . . . 0.0 116.185 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -137.15 147.89 46.26 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.883 1.673 . . . . 0.0 113.253 -175.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 43.0 t -76.85 141.85 40.47 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.058 1.343 . . . . 0.0 111.699 171.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.6 tppt? -144.9 148.89 34.41 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 127.964 2.506 . . . . 0.0 108.732 175.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 10.5 m -104.41 156.39 17.97 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.3 m -140.18 151.56 64.99 Favored Pre-proline 0 N--CA 1.472 0.654 0 C-N-CA 126.488 1.915 . . . . 0.0 111.485 -176.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.49 160.13 50.95 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 124.122 3.215 . . . . 0.0 113.315 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 . . . . . 0 C--O 1.255 1.38 0 C-N-CA 126.098 1.759 . . . . 0.0 113.767 172.51 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 . . . . . 0 CA--C 1.537 0.449 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.4 tp -57.87 -36.89 72.99 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 118.044 -0.979 . . . . 0.0 113.051 -175.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.0 -45.3 93.06 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 120.047 1.294 . . . . 0.0 112.646 173.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 21.7 ttm180 -65.78 -37.46 86.37 Favored 'General case' 0 C--N 1.346 0.414 0 C-N-CA 125.601 1.561 . . . . 0.0 113.054 175.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.6 t -72.44 -43.89 63.16 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 125.669 1.588 . . . . 0.0 110.064 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -59.82 -43.12 94.71 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.836 -0.54 . . . . 0.0 110.81 172.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 63.1 mt -64.72 -40.38 95.24 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.066 0.848 . . . . 0.0 113.157 173.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.4 m -68.59 -39.23 81.02 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.002 0.921 . . . . 0.0 111.1 -179.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.4 m -73.93 -30.08 62.37 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 171.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -62.63 -33.22 74.57 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.196 -1.565 . . . . 0.0 111.908 170.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 44.2 m -66.47 -11.87 54.44 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 170.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.1 mt -102.72 -19.49 14.73 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 120.458 1.481 . . . . 0.0 112.318 166.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 103.6 30.77 5.13 Favored Glycine 0 CA--C 1.538 1.474 0 C-N-CA 125.789 1.661 . . . . 0.0 115.376 177.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -150.36 -177.59 6.03 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.774 1.23 . . . . 0.0 113.409 178.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.7 tp -83.34 145.82 28.84 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.629 1.572 . . . . 0.0 111.577 -174.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -105.53 144.97 15.86 Favored Glycine 0 N--CA 1.472 1.081 0 C-N-CA 123.735 0.684 . . . . 0.0 113.452 175.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -137.76 151.54 48.27 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.203 1.801 . . . . 0.0 112.401 175.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 75.1 m -96.43 118.66 33.42 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 124.67 1.188 . . . . 0.0 109.787 170.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.6 mp -104.48 104.6 17.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 125.538 1.535 . . . . 0.0 107.116 178.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.65 -77.1 0.06 OUTLIER Glycine 0 CA--C 1.53 1.008 0 C-N-CA 125.29 1.424 . . . . 0.0 112.83 -167.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -142.64 0.8 1.29 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.724 1.609 . . . . 0.0 114.495 -177.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -128.03 150.26 50.01 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 119.593 1.088 . . . . 0.0 113.065 -177.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 45.0 t -77.85 134.58 37.93 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.761 1.624 . . . . 0.0 112.964 -175.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -141.62 165.88 26.28 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 127.982 2.513 . . . . 0.0 109.709 165.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.9 m -114.52 153.94 29.12 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 114.442 1.275 . . . . 0.0 114.442 -175.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.3 m -145.92 164.71 23.94 Favored Pre-proline 0 N--CA 1.485 1.309 0 C-N-CA 127.646 2.379 . . . . 0.0 111.665 -177.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -66.78 153.25 78.6 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.741 2.294 . . . . 0.0 113.077 172.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 . . . . . 0 C--O 1.25 1.084 0 C-N-CA 126.537 1.935 . . . . 0.0 113.255 177.443 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.444 ' N ' ' HG ' ' A' ' 23' ' ' CYS . 51.1 t-20 . . . . . 0 CA--C 1.539 0.556 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 61.7 tp -49.38 -41.85 40.41 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.597 1.159 . . . . 0.0 111.904 172.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.31 -33.62 76.41 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 -176.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 60.1 ttt180 -78.62 -43.08 27.16 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 126.546 1.938 . . . . 0.0 111.125 175.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 25.1 t -71.07 -41.05 71.2 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 127.353 2.261 . . . . 0.0 112.087 -173.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -53.95 -45.28 71.24 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 119.239 0.927 . . . . 0.0 112.773 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.01 -35.24 61.99 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.781 1.232 . . . . 0.0 111.937 -178.079 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 69.2 m -71.72 -35.82 70.3 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.446 0.698 . . . . 0.0 112.755 173.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 81.1 m -71.52 -27.75 63.41 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 119.485 1.038 . . . . 0.0 113.145 172.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.36 -38.72 66.39 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.323 1.049 . . . . 0.0 113.755 -176.022 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 88.5 p -69.04 -11.85 61.16 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 -175.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.1 mt -108.23 1.74 22.27 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.203 1.401 . . . . 0.0 112.1 174.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.14 17.83 35.98 Favored Glycine 0 CA--C 1.535 1.283 0 C-N-CA 126.08 1.8 . . . . 0.0 116.372 170.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -136.76 -175.05 3.89 Favored 'General case' 0 CA--C 1.551 0.987 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 -171.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 70.1 mt -92.83 156.73 16.79 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 126.505 1.922 . . . . 0.0 111.148 -176.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -112.93 150.61 18.41 Favored Glycine 0 N--CA 1.472 1.058 0 C-N-CA 124.247 0.927 . . . . 0.0 114.311 176.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -142.76 154.54 44.35 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 127.956 2.502 . . . . 0.0 111.978 170.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.444 ' HG ' ' N ' ' A' ' 6' ' ' ASN . 0.8 OUTLIER -118.83 120.7 38.1 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.144 1.778 . . . . 0.0 111.452 -177.976 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.5 mp -141.93 128.33 19.2 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 125.627 1.571 . . . . 0.0 109.722 -177.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.94 44.07 94.64 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 124.396 0.998 . . . . 0.0 114.499 170.093 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.264 4.2 mm-40 62.42 20.54 11.95 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 126.535 1.934 . . . . 0.0 115.273 -175.359 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -131.75 142.9 49.9 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.603 -1.31 . . . . 0.0 113.055 173.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 10.2 t -76.84 134.39 39.06 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.805 1.242 . . . . 0.0 111.141 165.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.1 ttpt -138.83 138.4 37.48 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.641 1.176 . . . . 0.0 110.45 167.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.0 m -96.39 144.49 26.48 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.675 0.79 . . . . 0.0 112.083 -172.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.0 m -128.32 151.95 77.25 Favored Pre-proline 0 N--CA 1.473 0.683 0 C-N-CA 126.576 1.95 . . . . 0.0 112.093 -170.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.79 151.32 57.2 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.02 2.48 . . . . 0.0 112.625 -176.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 . . . . . 0 C--O 1.251 1.156 0 C-N-CA 124.119 0.967 . . . . 0.0 110.417 165.398 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 . . . . . 0 CA--C 1.535 0.374 0 N-CA-C 105.876 -1.898 . . . . 0.0 105.876 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 51.6 tp -57.53 -37.17 72.6 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.399 -0.81 . . . . 0.0 111.814 -176.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.61 -47.84 58.1 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.503 1.047 . . . . 0.0 112.663 -179.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.84 -43.31 76.9 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.195 1.398 . . . . 0.0 111.669 176.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.7 t -72.81 -50.94 21.03 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 126.959 2.103 . . . . 0.0 110.693 -178.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -53.32 -49.63 66.65 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.944 0.898 . . . . 0.0 111.457 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 87.4 mt -74.46 -34.31 63.12 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.476 1.11 . . . . 0.0 113.27 -175.101 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 37.7 m -66.82 -45.96 76.64 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.002 0.521 . . . . 0.0 110.659 170.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 73.0 m -58.96 -36.61 75.11 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 122.816 0.446 . . . . 0.0 111.599 171.214 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -34.43 71.85 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 120.623 -1.298 . . . . 0.0 113.422 175.663 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.8 p -66.11 -15.03 62.74 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 174.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.5 mt -102.59 -9.49 20.09 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.509 1.123 . . . . 0.0 112.023 170.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 120.42 -9.81 10.82 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 126.782 2.134 . . . . 0.0 116.354 172.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -125.59 -173.14 2.76 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 115.76 1.763 . . . . 0.0 115.76 -159.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 79.3 mt -94.01 161.69 14.19 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.222 1.409 . . . . 0.0 111.856 -175.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -118.12 137.6 13.2 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 125.343 1.449 . . . . 0.0 113.116 173.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.7 mptt -134.07 134.86 42.82 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 127.21 2.204 . . . . 0.0 110.66 174.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 29.1 m -75.08 151.68 38.63 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 121.745 0.783 . . . . 0.0 112.261 175.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 30.3 mt -123.83 75.63 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 126.445 1.898 . . . . 0.0 107.556 174.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.15 -96.61 0.14 Allowed Glycine 0 CA--C 1.531 1.07 0 CA-C-N 114.337 -1.301 . . . . 0.0 112.193 -170.722 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -98.5 -0.22 43.79 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.374 1.47 . . . . 0.0 114.578 -179.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -111.76 168.13 9.81 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 127.687 2.395 . . . . 0.0 111.071 177.718 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 9.2 t -146.13 138.11 25.08 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 120.704 -1.247 . . . . 0.0 114.231 167.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 33.7 mmtm -139.06 163.07 33.37 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 126.235 1.814 . . . . 0.0 110.861 -174.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 7.5 m -89.09 156.74 18.64 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -177.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.4 m -148.58 152.23 37.64 Favored Pre-proline 0 N--CA 1.466 0.359 0 C-N-CA 126.218 1.807 . . . . 0.0 111.92 -176.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -73.07 165.69 32.06 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.39 2.727 . . . . 0.0 112.273 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 . . . . . 0 C--O 1.249 1.068 0 C-N-CA 126.217 1.807 . . . . 0.0 112.272 -178.931 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 . . . . . 0 CA--C 1.534 0.356 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 65.4 tp -64.15 -37.64 88.2 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 117.891 -1.052 . . . . 0.0 112.999 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.39 -46.12 90.06 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 120.208 1.367 . . . . 0.0 111.542 178.209 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -65.85 -39.7 91.0 Favored 'General case' 0 C--N 1.346 0.441 0 C-N-CA 125.076 1.351 . . . . 0.0 112.841 173.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 19.7 t -63.13 -48.26 79.27 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 124.988 1.315 . . . . 0.0 110.124 178.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -59.88 -47.52 85.42 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.778 0.831 . . . . 0.0 111.104 175.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 51.4 mt -61.1 -44.48 97.29 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.968 0.804 . . . . 0.0 112.555 177.008 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 58.7 m -72.51 -41.03 66.38 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.163 0.985 . . . . 0.0 112.367 -178.224 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 77.0 m -64.33 -39.13 93.29 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.109 0.868 . . . . 0.0 110.992 172.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.1 ttm105 -67.02 -28.73 68.47 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.074 -1.016 . . . . 0.0 113.106 178.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 61.8 m -64.3 -11.14 28.93 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.614 1.339 . . . . 0.0 114.614 168.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.13 2.17 16.61 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 125.251 1.42 . . . . 0.0 112.18 170.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 90.94 18.37 47.51 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 126.074 1.797 . . . . 0.0 116.161 173.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -136.56 178.24 7.22 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 119.119 1.459 . . . . 0.0 114.344 -176.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -94.0 134.06 36.81 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.38 1.872 . . . . 0.0 111.718 -162.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -91.83 132.05 11.08 Favored Glycine 0 CA--C 1.532 1.114 0 CA-C-N 118.491 0.587 . . . . 0.0 113.821 179.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.5 tppt? -123.9 139.14 54.26 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 126.59 1.956 . . . . 0.0 111.56 176.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 7.1 t -105.6 125.63 51.21 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.989 0.915 . . . . 0.0 110.367 175.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.0 mt -118.51 82.79 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 125.302 1.441 . . . . 0.0 108.258 -177.016 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.57 -93.82 0.03 OUTLIER Glycine 0 CA--C 1.532 1.152 0 C-N-CA 125.229 1.395 . . . . 0.0 111.798 -167.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -96.49 -10.49 27.29 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.165 1.786 . . . . 0.0 114.819 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -105.0 147.6 27.62 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 120.52 1.509 . . . . 0.0 114.463 -175.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.4 t -106.52 121.33 44.08 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 124.817 1.247 . . . . 0.0 110.22 171.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -125.87 147.84 49.35 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 126.01 1.724 . . . . 0.0 109.971 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 6.9 m -107.49 143.69 35.5 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 122.792 0.437 . . . . 0.0 111.915 173.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.6 m -135.21 149.05 68.91 Favored Pre-proline 0 N--CA 1.474 0.769 0 C-N-CA 125.18 1.392 . . . . 0.0 112.603 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -82.84 58.74 6.51 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 124.468 3.446 . . . . 0.0 112.656 -170.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 . . . . . 0 C--O 1.252 1.199 0 C-N-CA 127.642 2.377 . . . . 0.0 114.171 -179.44 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 . . . . . 0 CA--C 1.535 0.381 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 41.8 tp -63.65 -33.21 75.11 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 118.232 -0.889 . . . . 0.0 112.657 -175.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.27 -44.66 78.77 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 119.52 1.055 . . . . 0.0 112.795 177.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -77.49 -29.91 52.79 Favored 'General case' 0 C--N 1.344 0.353 0 C-N-CA 124.148 0.979 . . . . 0.0 113.447 178.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.8 t -68.07 -44.26 76.73 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 124.965 1.306 . . . . 0.0 110.121 170.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -57.54 -47.35 82.24 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.879 0.763 . . . . 0.0 110.931 171.19 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.6 tt -57.32 -46.14 83.51 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.832 0.853 . . . . 0.0 111.239 176.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 48.8 m -70.35 -47.63 60.11 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.519 1.127 . . . . 0.0 112.82 -178.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 70.7 m -63.4 -42.88 98.8 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 118.639 0.654 . . . . 0.0 111.179 175.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.5 ttm-85 -74.2 -22.07 59.54 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.745 -1.222 . . . . 0.0 112.651 -177.078 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.8 m -72.19 -16.69 61.97 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 167.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.1 mt -89.53 -30.17 18.41 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.271 0.941 . . . . 0.0 111.333 163.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 128.28 12.88 2.73 Favored Glycine 0 CA--C 1.536 1.372 0 C-N-CA 125.672 1.606 . . . . 0.0 115.744 173.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -135.4 173.57 11.57 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 119.609 1.704 . . . . 0.0 114.595 -172.392 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.8 tp -84.87 135.85 33.9 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.379 1.471 . . . . 0.0 111.544 -167.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.58 137.99 15.86 Favored Glycine 0 CA--C 1.538 1.494 0 CA-C-N 118.725 0.693 . . . . 0.0 113.299 170.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.11 128.21 22.3 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.014 1.726 . . . . 0.0 113.878 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 6.7 t -91.63 133.42 35.58 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.265 1.426 . . . . 0.0 111.587 -179.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 13.1 mt -138.98 112.97 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.751 1.221 . . . . 0.0 110.396 -175.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.11 -100.76 0.43 Allowed Glycine 0 CA--C 1.53 1.017 0 N-CA-C 110.558 -1.017 . . . . 0.0 110.558 -168.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -126.99 7.95 6.69 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 126.671 1.988 . . . . 0.0 113.965 176.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -123.61 150.14 44.49 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.707 1.203 . . . . 0.0 110.258 -178.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.1 t -105.44 145.98 30.12 Favored 'General case' 0 CA--C 1.537 0.481 0 O-C-N 121.372 -0.83 . . . . 0.0 112.581 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -122.16 163.42 19.56 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 128.193 2.597 . . . . 0.0 109.839 174.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.9 m -106.34 149.18 27.21 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 122.056 -0.403 . . . . 0.0 111.598 163.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.2 m -142.4 156.09 64.03 Favored Pre-proline 0 N--CA 1.479 0.995 0 C-N-CA 124.999 1.32 . . . . 0.0 113.714 -172.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -84.5 51.55 3.3 Favored 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 124.987 3.791 . . . . 0.0 113.056 -172.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 . . . . . 0 C--O 1.252 1.229 0 C-N-CA 126.577 1.951 . . . . 0.0 113.604 -178.062 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 . . . . . 0 CA--C 1.534 0.361 0 N-CA-C 106.697 -1.594 . . . . 0.0 106.697 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 29.7 tp -59.22 -40.86 87.18 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.754 1.161 . . . . 0.0 112.438 -173.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.7 -48.49 81.54 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 119.488 1.04 . . . . 0.0 112.433 178.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -60.07 -43.42 95.47 Favored 'General case' 0 C--N 1.346 0.432 0 C-N-CA 125.645 1.578 . . . . 0.0 112.832 172.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 7.9 t -77.38 -43.38 32.96 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 124.986 1.314 . . . . 0.0 111.44 -169.58 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -58.72 -44.49 90.43 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.823 1.192 . . . . 0.0 111.162 171.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 79.1 mt -64.55 -38.5 91.22 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 175.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 63.0 m -79.1 -32.38 44.6 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.763 1.225 . . . . 0.0 113.116 -179.24 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 58.6 m -73.33 -27.29 61.44 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 119.009 -0.519 . . . . 0.0 111.129 169.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -35.79 75.33 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 119.836 1.198 . . . . 0.0 112.944 167.658 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.7 m -63.51 -19.94 65.19 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.222 1.009 . . . . 0.0 113.083 174.632 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 21.0 mt -100.2 -27.24 13.62 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.28 1.432 . . . . 0.0 112.349 172.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 105.33 17.97 12.83 Favored Glycine 0 CA--C 1.539 1.59 0 C-N-CA 126.199 1.857 . . . . 0.0 115.911 178.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -134.56 -177.56 4.66 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.382 1.591 . . . . 0.0 113.13 -175.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 30.3 tp -91.27 140.83 29.42 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.121 1.768 . . . . 0.0 112.706 -165.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -92.14 141.71 15.72 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 124.817 1.199 . . . . 0.0 115.938 -178.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.3 tppt? -143.53 173.62 11.48 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 128.054 2.542 . . . . 0.0 112.927 176.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 35.8 t -126.2 144.73 50.66 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.526 1.53 . . . . 0.0 110.864 174.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 55.6 mt -135.54 118.16 22.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 124.288 1.035 . . . . 0.0 108.348 166.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.23 -79.92 0.63 Allowed Glycine 0 N--CA 1.472 1.055 0 C-N-CA 124.327 0.965 . . . . 0.0 114.412 171.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -150.83 18.42 0.79 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 127.833 2.453 . . . . 0.0 112.003 176.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -120.45 145.37 47.31 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.429 2.292 . . . . 0.0 112.663 -177.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 2.1 t -83.88 132.36 34.8 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 124.946 1.298 . . . . 0.0 110.06 169.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -136.31 131.4 34.3 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.75 1.22 . . . . 0.0 110.319 -177.594 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 6.3 m -99.19 144.27 28.51 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.182 0.593 . . . . 0.0 111.796 177.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.0 m -134.65 155.19 79.72 Favored Pre-proline 0 N--CA 1.474 0.756 0 C-N-CA 125.921 1.689 . . . . 0.0 112.702 -177.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -71.38 161.99 43.81 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.719 2.946 . . . . 0.0 112.659 174.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 83.7 m-85 . . . . . 0 C--O 1.251 1.143 0 C-N-CA 125.421 1.488 . . . . 0.0 114.065 -176.238 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 55.2 t-20 . . . . . 0 CA--C 1.536 0.406 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 42.3 tp -52.26 -41.12 62.55 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.071 0.948 . . . . 0.0 112.647 177.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.25 90.27 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 118.939 0.79 . . . . 0.0 112.91 -177.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 59.7 ttt180 -71.42 -43.21 67.18 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.701 1.6 . . . . 0.0 111.401 174.277 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 19.7 t -68.46 -40.06 81.19 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 126.442 1.897 . . . . 0.0 112.007 -176.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -60.05 -44.11 94.9 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.802 0.728 . . . . 0.0 112.299 178.379 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -74.16 -33.98 63.68 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.75 0.82 . . . . 0.0 112.448 177.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 28.4 m -65.49 -47.28 76.59 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 121.601 -0.687 . . . . 0.0 111.87 172.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.2 m -70.81 -34.54 71.84 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 118.735 0.698 . . . . 0.0 112.594 177.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 41.9 ttm180 -54.91 -34.35 63.04 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 121.289 -0.882 . . . . 0.0 111.161 168.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.3 m -77.54 0.58 22.4 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 176.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.2 mt -115.92 -3.83 12.12 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 125.278 1.431 . . . . 0.0 112.075 165.119 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.43 19.02 31.23 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 125.733 1.635 . . . . 0.0 116.383 175.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -143.78 -172.05 3.66 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.367 1.467 . . . . 0.0 112.89 -179.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 20.5 tp -94.25 150.77 19.99 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.461 1.504 . . . . 0.0 111.901 -168.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -106.04 142.81 15.65 Favored Glycine 0 CA--C 1.532 1.113 0 O-C-N 121.424 -0.797 . . . . 0.0 114.523 177.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -142.64 160.94 39.32 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 128.031 2.532 . . . . 0.0 111.036 169.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 4.7 t -97.44 138.09 35.42 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.762 -0.586 . . . . 0.0 111.387 167.006 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 55.1 mt -126.49 116.04 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 125.358 1.463 . . . . 0.0 108.848 168.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.41 -96.65 0.15 Allowed Glycine 0 CA--C 1.532 1.127 0 C-N-CA 125.064 1.316 . . . . 0.0 112.453 -176.101 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -125.33 18.89 8.23 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 125.956 1.702 . . . . 0.0 113.62 178.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -129.61 145.27 51.5 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.295 1.438 . . . . 0.0 112.861 -174.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 9.6 t -74.95 128.11 34.79 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.231 0.613 . . . . 0.0 109.84 160.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -130.45 132.7 45.83 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.306 1.442 . . . . 0.0 108.776 174.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 22.5 m -92.84 139.7 30.27 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 120.787 0.327 . . . . 0.0 111.687 -177.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.7 m -127.34 152.69 76.61 Favored Pre-proline 0 N--CA 1.469 0.517 0 C-N-CA 126.011 1.725 . . . . 0.0 110.984 -168.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -63.24 158.93 41.83 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.287 2.658 . . . . 0.0 112.365 -177.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 . . . . . 0 C--O 1.253 1.262 0 C-N-CA 124.576 1.151 . . . . 0.0 109.765 159.591 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.714 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 77.6 p -66.95 -22.56 65.93 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 118.529 1.165 . . . . 0.0 112.091 169.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -126.8 158.37 36.76 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 126.613 1.965 . . . . 0.0 109.539 170.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -144.96 103.59 3.9 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.71 1.204 . . . . 0.0 111.024 176.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 50.2 t -62.72 143.8 57.06 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.38 0.672 . . . . 0.0 111.597 170.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -119.54 115.4 23.95 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.09 1.756 . . . . 0.0 108.339 172.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 53.9 tp -58.26 -45.25 88.16 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-O 117.909 -1.043 . . . . 0.0 112.316 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.2 -39.81 79.92 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 120.208 1.367 . . . . 0.0 112.957 175.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 32.5 ttp180 -78.16 -33.94 49.97 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.291 1.437 . . . . 0.0 113.379 -179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 35.6 t -69.19 -40.82 77.82 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 126.062 1.745 . . . . 0.0 109.933 171.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -61.64 -44.72 96.45 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.291 1.037 . . . . 0.0 111.639 175.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 26.8 mt -66.77 -28.72 68.62 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.177 1.391 . . . . 0.0 113.62 173.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 63.1 m -77.93 -47.78 17.83 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.729 1.212 . . . . 0.0 112.085 175.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 68.4 m -67.49 -31.6 71.85 Favored 'General case' 0 CA--C 1.549 0.91 0 O-C-N 121.248 -0.908 . . . . 0.0 111.774 178.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 42.4 ttm-85 -53.64 -32.95 53.5 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.529 1.532 . . . . 0.0 112.964 166.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.0 m -71.46 -16.74 62.38 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 114.301 1.222 . . . . 0.0 114.301 177.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.1 mt -108.27 -11.06 15.28 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.401 1.08 . . . . 0.0 112.459 175.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 98.42 27.19 8.77 Favored Glycine 0 CA--C 1.537 1.407 0 C-N-CA 125.621 1.581 . . . . 0.0 115.635 174.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -145.28 178.64 7.94 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 119.232 1.516 . . . . 0.0 112.725 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.3 tp -86.78 148.57 25.35 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.913 1.285 . . . . 0.0 111.639 -170.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -100.09 143.24 16.28 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 123.915 0.769 . . . . 0.0 114.099 173.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.13 157.4 44.93 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 127.344 2.258 . . . . 0.0 110.474 169.281 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 85.7 m -100.19 133.71 44.18 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.417 -0.802 . . . . 0.0 110.533 171.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 71.6 mt -138.5 125.14 25.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.181 1.393 . . . . 0.0 108.617 177.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.63 33.2 76.21 Favored Glycine 0 CA--C 1.539 1.552 0 O-C-N 121.487 -0.758 . . . . 0.0 114.265 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 60.72 21.11 11.13 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 127.043 2.137 . . . . 0.0 114.907 -172.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -120.72 152.5 38.19 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.156 1.783 . . . . 0.0 110.953 173.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 33.2 t -76.75 131.02 38.5 Favored 'General case' 0 C--O 1.241 0.657 0 O-C-N 121.593 -0.692 . . . . 0.0 110.525 176.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 42.9 tttt -139.35 127.61 22.67 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.729 1.212 . . . . 0.0 109.974 175.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 12.5 m -89.79 151.79 21.62 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.606 -177.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.4 m -141.05 150.55 59.47 Favored Pre-proline 0 N--CA 1.474 0.737 0 C-N-CA 124.883 1.273 . . . . 0.0 113.112 -175.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -79.19 65.89 8.82 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 124.66 3.574 . . . . 0.0 112.845 -175.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 . . . . . 0 C--O 1.253 1.261 0 C-N-CA 128.404 2.682 . . . . 0.0 114.159 -179.932 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.14 0 N-CA-C 112.067 -0.413 . . . . 0.0 112.067 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.5 t -148.9 23.26 0.97 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.448 1.099 . . . . 0.0 113.561 176.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -84.6 7.07 21.43 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 115.985 1.846 . . . . 0.0 115.985 -165.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 31.4 t80 46.35 48.09 13.6 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 125.356 1.463 . . . . 0.0 111.884 -167.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.5 t -80.27 142.18 34.82 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 126.038 1.735 . . . . 0.0 112.098 -167.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -141.35 150.77 42.87 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.308 1.443 . . . . 0.0 108.674 167.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 44.4 tp -53.91 -40.53 66.76 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 119.275 0.943 . . . . 0.0 112.001 167.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.29 -42.07 84.35 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.703 1.138 . . . . 0.0 112.981 177.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 31.8 mtp180 -69.13 -36.25 77.27 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.658 1.183 . . . . 0.0 112.386 177.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 16.0 t -78.0 -36.38 48.87 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 125.694 1.598 . . . . 0.0 110.854 178.122 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -55.09 -47.61 74.7 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.58 0.752 . . . . 0.0 111.258 167.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 53.5 mt -63.14 -50.73 69.27 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.222 0.609 . . . . 0.0 111.884 174.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 44.4 m -64.02 -43.51 95.37 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -176.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 78.6 m -65.44 -35.17 80.12 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.189 0.904 . . . . 0.0 112.631 173.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 26.4 ttm105 -69.77 -19.59 63.51 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 120.994 -1.066 . . . . 0.0 113.046 178.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.2 p -62.92 -31.1 72.1 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 118.569 0.622 . . . . 0.0 112.511 166.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 mt -91.31 -6.04 53.73 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.531 1.132 . . . . 0.0 112.555 173.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.24 12.46 39.07 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 126.623 2.059 . . . . 0.0 115.916 174.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -134.79 -177.71 4.75 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 120.08 1.94 . . . . 0.0 113.473 -175.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 80.6 mt -94.14 164.03 13.22 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.6 1.16 . . . . 0.0 111.894 -169.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -117.3 146.54 18.78 Favored Glycine 0 N--CA 1.474 1.225 0 N-CA-C 116.119 1.208 . . . . 0.0 116.119 -171.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 57.4 mmtt -133.9 134.38 42.6 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 127.348 2.259 . . . . 0.0 111.664 165.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 53.6 t -114.0 109.53 18.61 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.916 1.286 . . . . 0.0 109.925 -177.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 36.9 mm -140.14 127.06 23.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 124.475 1.11 . . . . 0.0 109.723 -167.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.29 29.72 75.8 Favored Glycine 0 CA--C 1.536 1.371 0 CA-C-O 119.379 -0.678 . . . . 0.0 114.609 177.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 62.46 29.32 17.11 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.933 1.693 . . . . 0.0 114.484 -175.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -135.41 155.03 51.22 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.569 1.948 . . . . 0.0 109.917 168.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 10.0 t -107.77 135.38 49.29 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.32 1.048 . . . . 0.0 112.321 -175.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 66.1 mmtt -136.83 153.62 50.74 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 127.156 2.182 . . . . 0.0 111.307 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 12.3 m -115.95 149.35 38.89 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 -174.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.3 m -138.6 156.97 72.9 Favored Pre-proline 0 N--CA 1.481 1.087 0 C-N-CA 127.051 2.14 . . . . 0.0 113.07 -170.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -83.44 165.37 14.34 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 124.069 3.179 . . . . 0.0 114.684 -173.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 . . . . . 0 C--O 1.256 1.402 0 C-N-CA 125.53 1.532 . . . . 0.0 112.012 167.595 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.12 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.4 m -100.82 -10.5 20.67 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.833 1.42 . . . . 0.0 114.833 -173.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 57.75 139.95 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 118.426 2.75 . . . . 0.0 118.426 178.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.1 t80 43.21 66.34 0.81 Allowed 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 127.566 2.346 . . . . 0.0 113.999 164.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 11.5 t -67.33 128.64 37.17 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.547 -0.751 . . . . 0.0 112.435 -165.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 45.3 t30 -115.42 114.04 24.54 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.425 1.09 . . . . 0.0 110.225 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 46.7 tp -57.67 -34.44 69.39 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 118.719 -0.658 . . . . 0.0 112.137 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.23 -46.63 87.96 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 118.975 0.807 . . . . 0.0 112.686 176.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 18.7 ttt180 -66.12 -45.02 82.59 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 126.038 1.735 . . . . 0.0 111.994 175.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 49.7 t -65.55 -44.66 86.15 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 125.402 1.481 . . . . 0.0 111.222 -176.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -54.64 -52.02 63.6 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.562 0.745 . . . . 0.0 111.16 176.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 16.6 tp -73.76 -28.25 61.58 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.662 1.185 . . . . 0.0 113.299 -176.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.4 m -73.4 -47.53 41.19 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.678 0.791 . . . . 0.0 110.867 173.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 95.7 m -60.89 -31.55 71.04 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 171.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -52.82 -32.2 42.96 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.355 1.062 . . . . 0.0 113.649 173.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 54.6 p -63.58 -24.27 67.73 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.3 mt -97.71 -8.75 27.99 Favored 'General case' 0 N--CA 1.477 0.903 0 O-C-N 121.047 -1.033 . . . . 0.0 112.22 174.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 111.47 6.6 25.2 Favored Glycine 0 CA--C 1.532 1.156 0 C-N-CA 126.716 2.103 . . . . 0.0 115.586 172.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -130.01 -172.04 2.68 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 119.972 1.886 . . . . 0.0 114.953 -167.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.2 mt -92.9 157.69 16.23 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.306 1.442 . . . . 0.0 111.203 -176.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -110.39 147.96 17.49 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 124.911 1.243 . . . . 0.0 113.941 174.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -134.23 148.68 50.89 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 126.948 2.099 . . . . 0.0 111.184 167.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.6 m -108.93 125.33 51.91 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.019 1.328 . . . . 0.0 111.1 175.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 mp -131.42 113.35 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 124.898 1.279 . . . . 0.0 110.145 177.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.68 -94.35 0.16 Allowed Glycine 0 CA--C 1.529 0.955 0 C-N-CA 124.139 0.876 . . . . 0.0 111.888 -177.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -114.74 -11.04 12.35 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.809 2.043 . . . . 0.0 113.657 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -112.82 139.88 48.08 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.298 1.039 . . . . 0.0 113.138 -164.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 16.8 t -85.75 122.41 29.8 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 125.168 1.387 . . . . 0.0 109.404 164.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -121.5 143.58 49.19 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.524 1.53 . . . . 0.0 109.117 172.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 10.7 m -99.2 149.35 23.17 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -178.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.9 m -140.92 152.26 64.87 Favored Pre-proline 0 N--CA 1.477 0.893 0 C-N-CA 125.032 1.333 . . . . 0.0 113.772 -174.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -70.58 170.28 17.94 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 124.221 3.281 . . . . 0.0 112.978 176.217 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 . . . . . 0 C--O 1.251 1.166 0 C-N-CA 125.015 1.326 . . . . 0.0 112.349 176.115 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.12 0 CA-C-O 119.56 -0.578 . . . . 0.0 111.756 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.0 p -91.51 -18.13 24.61 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 115.714 1.746 . . . . 0.0 115.714 -164.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -157.12 165.92 34.7 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.915 1.286 . . . . 0.0 111.108 -175.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -132.22 80.06 1.89 Allowed 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.141 1.376 . . . . 0.0 112.979 -169.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 35.8 t -78.81 144.73 34.8 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.42 -0.8 . . . . 0.0 111.992 173.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -133.55 131.65 39.98 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 124.519 1.128 . . . . 0.0 110.6 172.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 36.4 tp -58.17 -35.68 71.93 Favored 'General case' 0 C--O 1.223 -0.326 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 -177.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.43 -45.12 63.49 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 120.327 1.421 . . . . 0.0 111.704 176.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 21.1 ttm180 -63.05 -36.08 82.39 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.364 1.465 . . . . 0.0 112.926 177.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 28.1 t -77.75 -41.27 38.19 Favored 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 126.854 2.062 . . . . 0.0 111.03 176.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -58.77 -48.77 80.07 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.165 0.893 . . . . 0.0 111.023 171.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 75.3 mt -63.36 -37.32 86.82 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.704 0.802 . . . . 0.0 112.467 177.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 62.9 m -65.75 -51.11 61.89 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.329 0.651 . . . . 0.0 111.821 174.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.2 m -69.83 -35.44 74.77 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -179.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 36.1 ttm105 -65.85 -25.02 67.01 Favored 'General case' 0 N--CA 1.481 1.106 0 O-C-N 120.846 -1.159 . . . . 0.0 113.078 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.6 p -67.63 -15.65 63.76 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 169.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -104.95 -4.78 21.69 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 125.649 1.579 . . . . 0.0 112.306 175.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 97.44 17.31 31.73 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 126.511 2.005 . . . . 0.0 116.348 176.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -143.13 177.16 8.57 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 119.439 1.619 . . . . 0.0 113.365 -178.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.8 tp -91.23 145.78 24.38 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.196 0.998 . . . . 0.0 111.602 -169.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -99.77 141.68 15.59 Favored Glycine 0 N--CA 1.473 1.103 0 O-C-N 121.644 -0.66 . . . . 0.0 113.573 178.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -148.2 126.94 12.57 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 126.409 1.884 . . . . 0.0 109.01 -176.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 56.7 m -82.27 133.69 35.25 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.147 -0.971 . . . . 0.0 110.819 -177.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 50.5 mt -125.22 118.57 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 123.815 0.846 . . . . 0.0 109.096 175.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 68.67 -83.39 0.21 Allowed Glycine 0 CA--C 1.524 0.643 0 C-N-CA 125.709 1.623 . . . . 0.0 111.742 -176.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -143.1 3.1 1.35 Allowed 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.075 1.75 . . . . 0.0 112.831 -176.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -133.88 158.38 43.58 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.556 1.542 . . . . 0.0 112.751 -172.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 41.4 t -87.51 130.28 34.77 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.737 1.215 . . . . 0.0 112.479 -175.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -127.66 159.8 33.58 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 127.14 2.176 . . . . 0.0 109.744 172.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 8.3 m -122.59 141.53 51.6 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -176.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.5 m -133.52 157.89 76.92 Favored Pre-proline 0 N--CA 1.475 0.78 0 C-N-CA 126.702 2.001 . . . . 0.0 112.694 -167.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.5 154.73 68.38 Favored 'Trans proline' 0 C--O 1.241 0.643 0 C-N-CA 123.367 2.711 . . . . 0.0 112.454 171.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 . . . . . 0 C--O 1.252 1.225 0 C-N-CA 126.292 1.837 . . . . 0.0 112.528 175.209 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.184 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 89.8 p -164.38 150.7 10.92 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.937 1.695 . . . . 0.0 110.332 179.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -133.77 31.49 3.64 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 129.1 2.96 . . . . 0.0 112.54 6.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 71.0 t80 48.62 117.97 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 128.331 2.652 . . . . 0.0 115.215 -166.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 25.7 t -90.16 119.26 30.34 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 120.62 -1.3 . . . . 0.0 112.064 -179.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -99.7 119.86 38.78 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 126.932 2.093 . . . . 0.0 107.604 168.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.5 tp -62.8 -35.7 80.74 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-O 117.973 -1.013 . . . . 0.0 112.555 -175.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.74 -45.57 82.12 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 120.117 1.326 . . . . 0.0 111.998 173.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -60.41 -44.71 95.45 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 123.926 0.89 . . . . 0.0 111.465 176.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 33.9 t -68.66 -43.69 75.66 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 124.916 1.286 . . . . 0.0 110.946 178.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -53.84 -52.52 60.12 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 124.015 0.926 . . . . 0.0 110.545 176.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 75.7 mt -75.07 -37.64 61.55 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.435 1.094 . . . . 0.0 113.439 -176.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.9 m -60.17 -41.17 92.29 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.0 0.818 . . . . 0.0 111.182 170.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 73.8 m -71.66 -33.11 68.6 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 171.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.55 -35.7 76.67 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 120.74 -1.225 . . . . 0.0 112.382 178.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.6 m -62.48 -6.82 3.69 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 174.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -115.3 -3.57 12.47 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 125.476 1.511 . . . . 0.0 113.391 174.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.26 29.7 8.75 Favored Glycine 0 CA--C 1.541 1.675 0 C-N-CA 125.028 1.299 . . . . 0.0 116.17 175.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -150.89 -173.02 4.36 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.413 1.485 . . . . 0.0 112.026 178.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 11.1 mp -105.05 156.67 17.84 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.599 1.159 . . . . 0.0 111.726 -175.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -112.02 139.98 15.92 Favored Glycine 0 CA--C 1.525 0.675 0 C-N-CA 124.99 1.281 . . . . 0.0 113.155 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -131.12 149.78 52.44 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 126.593 1.957 . . . . 0.0 110.564 177.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 27.4 m -101.28 129.38 47.24 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 124.101 0.96 . . . . 0.0 111.98 -174.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 25.2 mt -128.35 90.74 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 124.908 1.283 . . . . 0.0 109.152 -174.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.76 -73.77 0.25 Allowed Glycine 0 CA--C 1.534 1.272 0 C-N-CA 125.964 1.745 . . . . 0.0 114.452 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -135.18 -2.75 2.5 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.684 1.994 . . . . 0.0 112.752 176.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -108.14 153.94 22.43 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 127.437 2.295 . . . . 0.0 111.32 -173.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 11.7 t -106.05 130.42 53.97 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.469 1.508 . . . . 0.0 110.064 171.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.4 mptt -126.99 148.36 50.1 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.201 1.801 . . . . 0.0 110.418 175.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 10.3 m -110.0 124.95 52.35 Favored 'General case' 0 C--O 1.238 0.48 0 C-N-CA 123.818 0.847 . . . . 0.0 111.742 -178.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.0 m -99.21 144.91 29.11 Favored Pre-proline 0 N--CA 1.471 0.607 0 C-N-CA 126.008 1.723 . . . . 0.0 113.493 -167.349 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -74.99 117.87 5.07 Favored 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 123.091 2.527 . . . . 0.0 115.048 -153.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 . . . . . 0 C--O 1.256 1.43 0 C-N-CA 126.856 2.062 . . . . 0.0 112.554 170.059 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.18 0 N-CA-C 111.951 -0.46 . . . . 0.0 111.951 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.5 -26.22 59.86 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.193 0.997 . . . . 0.0 112.558 170.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -150.89 176.95 10.6 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 127.613 2.365 . . . . 0.0 108.66 166.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 11.6 p90 -141.79 139.13 32.69 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 125.062 1.345 . . . . 0.0 109.99 170.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 30.0 t -86.99 141.59 28.56 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.605 1.562 . . . . 0.0 110.333 171.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -107.12 113.72 27.34 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.838 0.855 . . . . 0.0 109.251 173.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.1 tp -67.69 -32.52 73.24 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-O 118.552 -0.737 . . . . 0.0 111.884 -174.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.36 -43.53 98.6 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 119.37 0.986 . . . . 0.0 111.895 174.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 32.7 ttp85 -70.98 -36.1 72.38 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 125.38 1.472 . . . . 0.0 112.803 177.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 37.7 t -73.33 -39.69 65.05 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 126.003 1.721 . . . . 0.0 111.119 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -57.98 -52.1 66.92 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 123.43 0.692 . . . . 0.0 109.867 171.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 76.4 mt -59.31 -41.21 88.51 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 119.275 0.943 . . . . 0.0 112.639 174.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.2 m -64.03 -47.37 80.51 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.861 0.865 . . . . 0.0 112.369 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 93.7 m -73.01 -37.23 67.03 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 177.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 40.8 ttm-85 -70.3 -23.47 62.86 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.696 1.198 . . . . 0.0 112.239 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.6 m -63.3 -17.35 62.44 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.26 1.024 . . . . 0.0 113.672 166.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.07 -0.19 25.02 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 126.195 1.798 . . . . 0.0 112.547 173.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.86 26.86 30.63 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 125.266 1.412 . . . . 0.0 116.169 175.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -144.63 -179.69 6.73 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.651 1.581 . . . . 0.0 113.092 176.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 21.6 tp -88.19 141.49 28.52 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.581 1.552 . . . . 0.0 111.745 -167.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -93.56 141.88 15.74 Favored Glycine 0 CA--C 1.532 1.135 0 O-C-N 121.931 -0.481 . . . . 0.0 113.82 174.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -138.72 151.56 47.25 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.819 2.048 . . . . 0.0 111.758 172.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 33.6 m -103.18 114.26 28.41 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.75 1.22 . . . . 0.0 110.094 174.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 51.5 mt -141.24 107.8 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 124.92 1.288 . . . . 0.0 110.699 -173.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.7 51.28 5.23 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 124.9 1.238 . . . . 0.0 113.282 177.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 79.3 mt-10 57.7 10.43 1.05 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 126.252 1.821 . . . . 0.0 114.655 -171.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -133.7 154.73 50.72 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.859 1.663 . . . . 0.0 112.755 -168.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 40.0 t -83.07 135.86 34.68 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.39 1.076 . . . . 0.0 111.611 175.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 30.7 tptt -142.51 146.88 35.16 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.968 1.707 . . . . 0.0 110.746 176.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.0 m -105.56 144.13 32.75 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.8 m -135.35 156.02 78.23 Favored Pre-proline 0 N--CA 1.474 0.77 0 C-N-CA 126.285 1.834 . . . . 0.0 110.916 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -63.13 155.03 63.72 Favored 'Trans proline' 0 CA--C 1.536 0.58 0 C-N-CA 122.568 2.178 . . . . 0.0 112.245 173.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 . . . . . 0 C--O 1.251 1.149 0 C-N-CA 124.194 0.998 . . . . 0.0 111.561 171.507 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.932 0 N-CA-C 110.353 -1.099 . . . . 0.0 110.353 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.5 m -85.55 4.87 34.02 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -173.286 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 54.32 5.27 0.08 Allowed 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 119.503 3.149 . . . . 0.0 119.503 177.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -145.53 76.42 1.47 Allowed 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 120.917 1.69 . . . . 0.0 114.492 -171.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 36.5 t -139.13 141.48 38.08 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.266 -0.896 . . . . 0.0 112.607 163.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -123.51 130.92 53.39 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.695 1.598 . . . . 0.0 108.623 166.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 42.8 tp -61.76 -38.16 86.96 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 117.924 -1.036 . . . . 0.0 113.0 -175.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -69.35 -38.11 77.98 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 120.569 1.532 . . . . 0.0 112.448 176.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.5 tmm_? -61.96 -38.89 90.24 Favored 'General case' 0 C--N 1.344 0.369 0 C-N-CA 124.633 1.173 . . . . 0.0 112.999 172.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 34.4 t -77.76 -38.73 46.24 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 125.313 1.445 . . . . 0.0 111.404 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -62.31 -45.49 93.03 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.518 0.599 . . . . 0.0 110.294 177.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 39.0 tp -62.16 -44.36 96.78 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.722 1.209 . . . . 0.0 112.506 172.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.8 m -60.64 -50.3 74.08 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 122.791 0.437 . . . . 0.0 110.934 178.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 80.5 m -66.25 -34.97 79.22 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 177.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 55.3 ttm-85 -58.06 -38.01 75.5 Favored 'General case' 0 N--CA 1.479 0.984 0 O-C-N 120.877 -1.14 . . . . 0.0 111.985 173.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 21.2 p -63.01 -17.51 62.28 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 176.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 mt -102.39 -10.68 19.24 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.773 1.229 . . . . 0.0 112.603 176.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 106.32 20.0 9.5 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 125.755 1.645 . . . . 0.0 116.399 176.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -149.49 -173.19 4.33 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 119.465 1.633 . . . . 0.0 113.169 -177.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 26.2 tp -98.25 157.93 15.87 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.256 1.422 . . . . 0.0 111.732 -174.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -116.93 147.98 18.88 Favored Glycine 0 N--CA 1.471 1.032 0 N-CA-C 115.251 0.861 . . . . 0.0 115.251 -178.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -136.43 153.3 51.11 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 128.168 2.587 . . . . 0.0 110.854 171.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 50.5 m -98.67 115.14 28.03 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.638 1.175 . . . . 0.0 109.566 171.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.6 mm -127.77 119.87 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 125.725 1.61 . . . . 0.0 108.965 -176.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.22 40.88 92.42 Favored Glycine 0 CA--C 1.533 1.194 0 C-N-CA 123.631 0.634 . . . . 0.0 113.113 -173.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 49.32 30.87 3.42 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 127.41 2.284 . . . . 0.0 115.52 -170.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -128.09 151.78 48.78 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.796 1.638 . . . . 0.0 110.144 171.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 53.4 t -75.52 137.49 40.91 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.468 -0.77 . . . . 0.0 111.136 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -147.92 130.44 15.83 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 127.291 2.237 . . . . 0.0 109.057 -173.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 13.2 m -107.48 146.58 31.59 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 122.581 1.182 . . . . 0.0 113.755 -171.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.7 m -138.5 156.94 73.07 Favored Pre-proline 0 N--CA 1.476 0.862 0 C-N-CA 126.703 2.001 . . . . 0.0 111.733 -172.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -64.91 144.49 83.08 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.677 2.251 . . . . 0.0 111.008 169.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 52.3 m-85 . . . . . 0 C--O 1.256 1.434 0 C-N-CA 125.288 1.435 . . . . 0.0 113.177 -178.649 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.108 0 CA-C-O 121.03 0.239 . . . . 0.0 112.614 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 78.2 p -142.56 2.79 1.44 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.666 1.987 . . . . 0.0 114.642 -171.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 57.03 64.14 1.72 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.968 1.707 . . . . 0.0 112.375 -173.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.8 t80 59.6 110.83 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 127.393 2.277 . . . . 0.0 113.264 -165.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 29.6 t -57.15 134.34 55.79 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.315 1.446 . . . . 0.0 111.748 -175.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 62.8 t-20 -86.52 109.82 19.36 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 124.171 0.988 . . . . 0.0 109.997 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.8 tp -57.89 -34.96 70.37 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-O 117.763 -1.113 . . . . 0.0 112.74 176.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.88 -38.12 89.92 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 120.439 1.472 . . . . 0.0 112.675 177.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.9 ttm105 -78.84 -28.64 44.34 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 120.88 -1.138 . . . . 0.0 113.058 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 32.5 t -73.11 -41.62 63.83 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 125.372 1.469 . . . . 0.0 109.995 172.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -57.87 -46.2 85.21 Favored 'General case' 0 C--O 1.221 -0.409 0 C-N-CA 124.922 1.289 . . . . 0.0 110.0 174.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 39.0 tp -62.51 -50.72 70.26 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.232 1.013 . . . . 0.0 112.041 173.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 72.8 m -56.82 -37.87 71.81 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.378 1.071 . . . . 0.0 112.359 -179.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 68.8 m -85.12 -37.42 20.26 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 112.994 0.738 . . . . 0.0 112.994 178.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 28.9 ttm105 -64.55 -28.82 69.9 Favored 'General case' 0 N--CA 1.479 1.022 0 O-C-N 120.978 -1.076 . . . . 0.0 112.543 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.3 m -62.08 -24.62 67.22 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 170.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mt -96.31 -9.66 29.65 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.373 0.988 . . . . 0.0 112.299 176.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 101.19 20.42 13.85 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 125.391 1.472 . . . . 0.0 115.77 176.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -138.16 -173.25 3.47 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.816 1.646 . . . . 0.0 111.679 176.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 79.2 mt -103.93 161.77 13.69 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.334 1.053 . . . . 0.0 112.801 -170.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -96.2 151.97 20.09 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 124.348 0.975 . . . . 0.0 114.037 179.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.1 tptt -143.1 124.0 14.31 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 126.99 2.116 . . . . 0.0 110.371 173.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.6 m -100.02 122.03 42.28 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 123.555 0.742 . . . . 0.0 110.003 176.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.4 mp -115.58 99.66 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 176.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.48 -94.61 0.03 OUTLIER Glycine 0 CA--C 1.531 1.078 0 C-N-CA 125.84 1.686 . . . . 0.0 113.624 -176.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -104.16 -3.87 23.86 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.11 1.364 . . . . 0.0 114.475 -173.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -139.6 152.34 46.74 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 120.459 1.481 . . . . 0.0 113.602 -175.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 14.5 t -92.66 135.85 33.74 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.989 2.115 . . . . 0.0 112.703 -179.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -122.33 156.83 33.08 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 128.835 2.854 . . . . 0.0 109.23 171.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 28.8 m -112.14 141.37 45.91 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 118.895 0.771 . . . . 0.0 112.644 173.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.2 m -129.82 151.12 77.62 Favored Pre-proline 0 N--CA 1.471 0.622 0 C-N-CA 126.603 1.961 . . . . 0.0 112.245 -171.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -72.87 158.76 49.55 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.756 2.971 . . . . 0.0 113.696 -178.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 . . . . . 0 C--O 1.253 1.276 0 C-N-CA 125.787 1.635 . . . . 0.0 112.464 171.013 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.008 0 N-CA-C 111.181 -0.768 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.3 p -67.72 -13.71 62.34 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.588 1.155 . . . . 0.0 113.356 165.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -125.98 165.43 18.8 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.11 1.764 . . . . 0.0 110.479 164.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -144.16 125.74 14.99 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 127.721 2.409 . . . . 0.0 109.936 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 45.6 t -113.07 150.82 31.52 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.645 1.978 . . . . 0.0 114.754 -165.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -137.33 114.26 10.6 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.989 1.316 . . . . 0.0 111.111 168.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 60.8 tp -60.09 -38.32 82.57 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 117.75 -1.119 . . . . 0.0 112.94 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.34 -34.66 78.49 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 120.761 1.619 . . . . 0.0 113.319 179.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 48.2 ttp180 -69.15 -39.35 78.85 Favored 'General case' 0 C--N 1.343 0.293 0 C-N-CA 125.564 1.545 . . . . 0.0 111.593 171.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 24.5 t -70.9 -41.59 71.07 Favored 'General case' 0 C--O 1.22 -0.456 0 C-N-CA 125.21 1.404 . . . . 0.0 110.767 178.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -60.0 -50.65 72.92 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.787 1.235 . . . . 0.0 109.658 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 37.0 tp -62.52 -40.9 98.24 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.064 1.346 . . . . 0.0 112.696 176.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 71.0 m -62.29 -47.09 85.83 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.915 0.886 . . . . 0.0 111.127 174.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.0 m -72.46 -28.26 62.82 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 178.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.65 -37.23 78.15 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.636 -1.29 . . . . 0.0 113.474 177.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 95.1 p -77.03 -2.75 35.6 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.32 1.23 . . . . 0.0 114.32 -178.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -110.25 -1.52 17.26 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.47 1.508 . . . . 0.0 112.32 167.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.48 31.92 12.64 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 125.501 1.525 . . . . 0.0 115.706 175.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -147.25 -169.97 3.44 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-N 119.796 1.798 . . . . 0.0 114.529 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.0 tp -100.09 148.84 24.12 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.465 1.906 . . . . 0.0 111.538 -168.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -93.58 142.91 16.22 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 124.2 0.905 . . . . 0.0 113.784 176.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.0 tptt -132.96 143.35 49.4 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 127.735 2.414 . . . . 0.0 111.442 172.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 26.4 t -105.38 113.48 27.09 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 125.472 1.509 . . . . 0.0 109.795 172.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 60.8 mt -135.83 121.7 30.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 124.472 1.109 . . . . 0.0 108.326 -174.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.58 35.47 62.11 Favored Glycine 0 CA--C 1.535 1.31 0 O-C-N 122.104 -0.372 . . . . 0.0 113.508 -177.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.257 42.9 mt-10 58.45 20.83 7.82 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 126.499 1.92 . . . . 0.0 115.691 -177.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -117.41 155.02 30.35 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.899 1.279 . . . . 0.0 111.732 162.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 36.6 t -77.57 135.3 38.16 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.087 0.955 . . . . 0.0 111.357 175.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.9 tptp -140.61 128.81 22.29 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 126.029 1.731 . . . . 0.0 108.802 175.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 16.5 m -86.45 146.4 26.44 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.843 0.83 . . . . 0.0 112.245 179.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.9 m -140.83 161.46 53.98 Favored Pre-proline 0 N--CA 1.473 0.677 0 C-N-CA 127.064 2.145 . . . . 0.0 110.92 -170.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.31 153.85 76.32 Favored 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 122.522 2.148 . . . . 0.0 113.866 174.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 . . . . . 0 C--O 1.258 1.504 0 C-N-CA 125.746 1.618 . . . . 0.0 111.951 162.43 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.109 0 CA-C-O 119.375 -0.68 . . . . 0.0 113.28 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 84.5 p -151.05 3.31 0.45 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 167.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -139.86 173.29 11.68 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.717 1.607 . . . . 0.0 112.268 -177.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -138.07 85.9 2.13 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.743 1.217 . . . . 0.0 112.245 -167.462 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 51.1 t -73.07 149.48 43.11 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 124.968 1.307 . . . . 0.0 113.414 -177.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -121.36 120.18 34.28 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.761 1.624 . . . . 0.0 111.897 179.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 55.8 tp -65.02 -39.76 93.87 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 117.736 -1.126 . . . . 0.0 112.948 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.64 -41.06 96.4 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 120.598 1.544 . . . . 0.0 112.28 179.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 25.7 ttm180 -67.01 -36.45 82.18 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 126.206 1.803 . . . . 0.0 112.341 175.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 19.8 t -76.15 -38.97 56.06 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 124.776 1.23 . . . . 0.0 111.084 177.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -60.39 -45.17 94.53 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.847 0.859 . . . . 0.0 109.921 173.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -60.49 -47.4 86.29 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.253 1.421 . . . . 0.0 111.433 173.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.5 m -63.42 -36.87 85.18 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.221 1.008 . . . . 0.0 112.787 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 84.1 m -85.41 -35.51 21.26 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 28.2 ttm105 -69.93 -24.26 63.34 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 120.561 -1.337 . . . . 0.0 112.014 175.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 65.6 m -62.44 -15.8 51.49 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 164.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 12.0 mt -101.85 -32.81 10.06 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.903 1.228 . . . . 0.0 111.546 173.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.6 -4.28 4.0 Favored Glycine 0 CA--C 1.536 1.362 0 C-N-CA 125.19 1.376 . . . . 0.0 115.389 174.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.504 ' H ' HD23 ' A' ' 19' ' ' LEU . 2.4 pt? -119.49 -163.16 0.96 Allowed 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.144 2.178 . . . . 0.0 112.036 -173.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.4 mp -108.81 163.36 13.34 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.633 1.573 . . . . 0.0 111.499 -175.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -113.35 152.04 18.12 Favored Glycine 0 CA--C 1.536 1.38 0 C-N-CA 125.304 1.43 . . . . 0.0 114.97 -178.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 49.8 mmtt -142.22 152.78 43.43 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 128.752 2.821 . . . . 0.0 111.927 173.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 31.8 m -97.13 108.06 20.71 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.181 1.393 . . . . 0.0 110.421 170.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 49.4 mt -131.76 126.07 56.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 125.986 1.714 . . . . 0.0 109.272 -173.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 63.25 25.35 68.24 Favored Glycine 0 CA--C 1.54 1.626 0 C-N-CA 123.831 0.729 . . . . 0.0 114.288 -174.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 61.55 16.46 7.66 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 127.308 2.243 . . . . 0.0 115.098 -167.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -112.7 160.02 18.34 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.273 1.429 . . . . 0.0 111.753 169.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 40.8 t -72.22 136.57 46.42 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.405 -0.809 . . . . 0.0 111.38 167.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.2 tttt -141.68 141.34 33.34 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 126.666 1.986 . . . . 0.0 110.017 173.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.7 m -100.02 149.95 22.94 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.852 -0.53 . . . . 0.0 112.408 -177.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.4 m -138.29 147.07 54.16 Favored Pre-proline 0 N--CA 1.476 0.851 0 C-N-CA 125.29 1.436 . . . . 0.0 113.272 -179.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -76.1 161.01 36.04 Favored 'Trans proline' 0 CA--C 1.538 0.689 0 C-N-CA 124.632 3.554 . . . . 0.0 112.917 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 18.2 p90 . . . . . 0 C--O 1.25 1.128 0 C-N-CA 125.683 1.593 . . . . 0.0 113.628 179.947 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.231 0 N-CA-C 111.458 -0.657 . . . . 0.0 111.458 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 97.5 p -140.89 24.61 2.18 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 115.76 1.763 . . . . 0.0 115.76 -166.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.44 69.76 0.67 Allowed 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.952 2.101 . . . . 0.0 113.522 -173.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 80.3 t80 61.44 131.78 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 127.822 2.449 . . . . 0.0 114.821 -170.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 46.7 t -91.23 121.91 33.39 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.705 1.202 . . . . 0.0 110.466 173.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 53.6 t-20 -100.38 112.21 24.54 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.895 0.878 . . . . 0.0 109.444 178.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 33.3 tp -61.18 -30.72 70.58 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 117.92 -1.038 . . . . 0.0 112.624 -177.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.87 -51.59 68.65 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 120.127 1.33 . . . . 0.0 112.053 170.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -58.92 -41.64 87.77 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 125.915 1.686 . . . . 0.0 111.909 178.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.2 t -70.8 -48.3 54.93 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.033 1.733 . . . . 0.0 111.701 178.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.65 -44.44 85.67 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.402 1.081 . . . . 0.0 111.79 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -78.81 -29.43 44.81 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.211 1.404 . . . . 0.0 113.26 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 66.9 m -74.86 -40.02 61.22 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 118.769 0.713 . . . . 0.0 112.228 173.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 84.1 m -66.96 -32.72 74.15 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 118.032 0.378 . . . . 0.0 111.397 169.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -54.0 -38.77 65.45 Favored 'General case' 0 N--CA 1.48 1.026 0 O-C-N 121.016 -1.053 . . . . 0.0 112.897 172.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 73.1 m -72.76 -14.02 61.45 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 115.192 1.553 . . . . 0.0 115.192 -178.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.1 mt -95.75 -13.97 23.73 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.462 0.705 . . . . 0.0 111.441 167.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.97 30.67 5.96 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 126.486 1.993 . . . . 0.0 115.065 177.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -142.73 -163.47 1.63 Allowed 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 119.808 1.804 . . . . 0.0 113.025 176.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.2 mp -108.36 164.64 12.15 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.544 1.938 . . . . 0.0 111.58 -177.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -119.8 154.95 16.28 Favored Glycine 0 CA--C 1.538 1.478 0 C-N-CA 124.835 1.207 . . . . 0.0 115.126 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -135.78 152.82 51.5 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 128.257 2.623 . . . . 0.0 111.249 168.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.7 m -114.89 106.71 14.49 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.156 1.382 . . . . 0.0 112.223 176.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.716 HG22 ' H ' ' A' ' 25' ' ' GLY . 28.0 mm -87.61 -168.5 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 127.179 2.192 . . . . 0.0 108.486 174.051 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.716 ' H ' HG22 ' A' ' 24' ' ' ILE . . . -57.12 95.68 0.05 OUTLIER Glycine 0 CA--C 1.53 0.972 0 C-N-CA 125.11 1.338 . . . . 0.0 112.768 179.135 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 46.07 30.91 1.02 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 127.6 2.36 . . . . 0.0 114.986 -171.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -140.32 133.8 30.04 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.682 1.193 . . . . 0.0 113.934 -178.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 9.6 t -87.62 124.54 33.64 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 125.814 1.646 . . . . 0.0 110.902 175.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -119.26 147.97 43.67 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.204 1.802 . . . . 0.0 109.281 174.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 19.4 m -106.03 146.48 30.06 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 118.773 0.715 . . . . 0.0 111.533 174.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.6 m -133.51 153.11 80.19 Favored Pre-proline 0 N--CA 1.477 0.914 0 C-N-CA 125.786 1.634 . . . . 0.0 113.916 -169.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -66.87 146.0 76.51 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 124.122 3.214 . . . . 0.0 112.537 173.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 20.2 p90 . . . . . 0 C--O 1.255 1.372 0 C-N-CA 126.622 1.969 . . . . 0.0 112.707 -169.918 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.022 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 62.1 p -154.95 14.88 0.41 Allowed 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.846 1.258 . . . . 0.0 114.374 -178.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.5 10.69 0.76 Allowed 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 116.79 2.145 . . . . 0.0 116.79 176.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 49.75 128.64 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 129.991 3.316 . . . . 0.0 119.084 157.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 7.4 t -71.83 104.48 3.46 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 120.961 -1.087 . . . . 0.0 113.204 -177.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -155.22 116.13 3.92 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.264 1.425 . . . . 0.0 110.534 164.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 59.1 tp -60.38 -41.8 94.53 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 117.625 -1.178 . . . . 0.0 112.402 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.91 -49.73 71.5 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 120.098 1.317 . . . . 0.0 112.164 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.3 ttp-105 -59.94 -40.57 89.37 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 119.329 0.968 . . . . 0.0 112.338 176.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 7.2 t -69.96 -45.91 66.4 Favored 'General case' 0 C--O 1.222 -0.363 0 C-N-CA 125.176 1.39 . . . . 0.0 110.532 -179.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.42 ' CD ' HH12 ' A' ' 15' ' ' ARG . 4.0 mm-40 -57.08 -49.11 76.89 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 119.098 0.863 . . . . 0.0 111.591 174.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 87.3 mt -62.4 -41.44 98.66 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.378 1.071 . . . . 0.0 112.452 177.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.9 m -68.13 -42.63 79.91 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.153 0.981 . . . . 0.0 112.2 178.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 61.6 m -72.7 -28.63 62.79 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 178.146 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.42 HH12 ' CD ' ' A' ' 11' ' ' GLU . 0.0 OUTLIER -51.38 -43.91 62.01 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.577 1.151 . . . . 0.0 112.453 173.326 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.2 m -69.67 -8.34 46.83 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.36 1.464 . . . . 0.0 114.521 -177.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 mt -115.44 -0.49 13.1 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.203 1.401 . . . . 0.0 111.834 178.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.42 25.47 21.07 Favored Glycine 0 CA--C 1.535 1.296 0 N-CA-C 116.313 1.285 . . . . 0.0 116.313 173.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -148.45 -173.8 4.43 Favored 'General case' 0 CA--C 1.553 1.062 0 CA-C-N 119.197 1.498 . . . . 0.0 114.043 -177.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 89.5 mt -92.85 162.5 14.07 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.948 1.699 . . . . 0.0 111.778 -178.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -123.47 144.96 15.89 Favored Glycine 0 CA--C 1.533 1.214 0 C-N-CA 124.945 1.26 . . . . 0.0 113.935 177.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.93 158.01 43.61 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 125.195 1.398 . . . . 0.0 112.372 170.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 18.5 t -89.62 137.91 31.93 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.281 -0.887 . . . . 0.0 110.843 171.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 56.3 mt -111.51 99.8 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 169.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.06 -73.46 0.18 Allowed Glycine 0 CA--C 1.531 1.079 0 C-N-CA 126.366 1.936 . . . . 0.0 114.289 178.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -138.17 13.95 2.83 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 127.05 2.14 . . . . 0.0 113.587 -173.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -150.52 146.38 26.56 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 120.2 -1.562 . . . . 0.0 112.727 -170.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 10.3 t -78.31 135.78 37.58 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.077 0.951 . . . . 0.0 111.534 174.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -138.56 146.88 42.38 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.469 1.508 . . . . 0.0 110.192 162.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.4 m -88.0 153.96 20.87 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.931 -0.481 . . . . 0.0 111.524 176.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.6 m -138.13 151.78 70.52 Favored Pre-proline 0 N--CA 1.473 0.713 0 C-N-CA 126.677 1.991 . . . . 0.0 111.561 -171.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -74.36 164.98 32.86 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 124.072 3.181 . . . . 0.0 113.695 -169.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 . . . . . 0 C--O 1.258 1.524 0 C-N-CA 125.12 1.368 . . . . 0.0 113.043 169.556 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.928 0 N-CA-C 110.765 -0.934 . . . . 0.0 110.765 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.1 m -69.19 132.76 47.04 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.531 1.132 . . . . 0.0 112.347 -173.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -129.1 14.04 6.22 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.47 1.656 . . . . 0.0 115.47 -166.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 61.25 148.1 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 127.378 2.271 . . . . 0.0 115.342 -174.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.7 t -94.89 156.34 16.39 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.868 1.667 . . . . 0.0 111.568 172.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -131.86 124.19 29.06 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.264 1.426 . . . . 0.0 108.673 167.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 29.6 tp -61.46 -41.15 96.79 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 118.3 -0.857 . . . . 0.0 112.139 -173.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.41 -37.41 87.18 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-N 119.798 1.181 . . . . 0.0 113.903 176.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 54.3 ttp180 -70.28 -39.61 74.8 Favored 'General case' 0 C--N 1.343 0.305 0 C-N-CA 125.304 1.441 . . . . 0.0 112.284 175.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 45.0 t -72.44 -38.55 68.29 Favored 'General case' 0 C--O 1.223 -0.341 0 C-N-CA 125.78 1.632 . . . . 0.0 111.151 179.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -56.33 -52.29 65.1 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 124.703 1.201 . . . . 0.0 110.595 175.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 44.8 mt -69.57 -37.57 77.05 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.604 0.762 . . . . 0.0 112.944 176.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 68.6 m -58.06 -41.05 82.52 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 121.817 -0.552 . . . . 0.0 111.694 171.674 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 83.6 m -75.76 -31.96 59.76 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 173.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.12 -35.59 73.72 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 120.63 -1.294 . . . . 0.0 112.261 172.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.2 t -60.5 -15.77 30.41 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.716 1.607 . . . . 0.0 113.991 173.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.8 mt -110.23 -6.9 14.93 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.297 1.439 . . . . 0.0 112.497 173.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.22 23.36 10.53 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 125.623 1.583 . . . . 0.0 116.604 174.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -144.82 -173.12 3.98 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 119.091 1.446 . . . . 0.0 113.749 -177.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 91.1 mt -92.77 159.3 15.47 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.444 1.498 . . . . 0.0 111.575 -176.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -116.06 148.63 18.89 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 124.199 0.904 . . . . 0.0 114.684 -178.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -135.83 150.1 49.29 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 127.918 2.487 . . . . 0.0 111.79 172.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 50.6 m -97.15 107.22 19.7 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 123.526 0.731 . . . . 0.0 109.324 168.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.515 HG22 ' H ' ' A' ' 25' ' ' GLY . 45.6 mm -81.85 -177.26 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 164.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.515 ' H ' HG22 ' A' ' 24' ' ' ILE . . . -53.52 101.73 0.09 OUTLIER Glycine 0 CA--C 1.534 1.274 0 O-C-N 120.513 -1.367 . . . . 0.0 112.956 -177.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 61.14 7.67 1.69 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 127.97 2.508 . . . . 0.0 116.185 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -137.15 147.89 46.26 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.883 1.673 . . . . 0.0 113.253 -175.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 43.0 t -76.85 141.85 40.47 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.058 1.343 . . . . 0.0 111.699 171.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.6 tppt? -144.9 148.89 34.41 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 127.964 2.506 . . . . 0.0 108.732 175.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 10.5 m -104.41 156.39 17.97 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.3 m -140.18 151.56 64.99 Favored Pre-proline 0 N--CA 1.472 0.654 0 C-N-CA 126.488 1.915 . . . . 0.0 111.485 -176.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.49 160.13 50.95 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 124.122 3.215 . . . . 0.0 113.315 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 . . . . . 0 C--O 1.255 1.38 0 C-N-CA 126.098 1.759 . . . . 0.0 113.767 172.51 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.02 0 N-CA-C 111.231 -0.747 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.3 p -158.02 -27.22 0.08 Allowed 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 115.836 1.791 . . . . 0.0 115.836 -165.053 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -144.86 -11.95 0.57 Allowed 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 117.126 2.269 . . . . 0.0 117.126 -169.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 60.1 t80 55.49 120.32 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 128.246 2.618 . . . . 0.0 115.209 -174.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 33.8 t -74.58 124.25 26.32 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.402 1.081 . . . . 0.0 113.133 -173.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -104.57 118.77 37.4 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 161.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.4 tp -57.87 -36.89 72.99 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 118.044 -0.979 . . . . 0.0 113.051 -175.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.0 -45.3 93.06 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 120.047 1.294 . . . . 0.0 112.646 173.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 21.7 ttm180 -65.78 -37.46 86.37 Favored 'General case' 0 C--N 1.346 0.414 0 C-N-CA 125.601 1.561 . . . . 0.0 113.054 175.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.6 t -72.44 -43.89 63.16 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 125.669 1.588 . . . . 0.0 110.064 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -59.82 -43.12 94.71 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.836 -0.54 . . . . 0.0 110.81 172.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 63.1 mt -64.72 -40.38 95.24 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.066 0.848 . . . . 0.0 113.157 173.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.4 m -68.59 -39.23 81.02 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.002 0.921 . . . . 0.0 111.1 -179.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.4 m -73.93 -30.08 62.37 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 171.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -62.63 -33.22 74.57 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.196 -1.565 . . . . 0.0 111.908 170.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 44.2 m -66.47 -11.87 54.44 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 170.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.1 mt -102.72 -19.49 14.73 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 120.458 1.481 . . . . 0.0 112.318 166.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 103.6 30.77 5.13 Favored Glycine 0 CA--C 1.538 1.474 0 C-N-CA 125.789 1.661 . . . . 0.0 115.376 177.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -150.36 -177.59 6.03 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.774 1.23 . . . . 0.0 113.409 178.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.7 tp -83.34 145.82 28.84 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.629 1.572 . . . . 0.0 111.577 -174.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -105.53 144.97 15.86 Favored Glycine 0 N--CA 1.472 1.081 0 C-N-CA 123.735 0.684 . . . . 0.0 113.452 175.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -137.76 151.54 48.27 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.203 1.801 . . . . 0.0 112.401 175.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 75.1 m -96.43 118.66 33.42 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 124.67 1.188 . . . . 0.0 109.787 170.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.6 mp -104.48 104.6 17.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 125.538 1.535 . . . . 0.0 107.116 178.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.65 -77.1 0.06 OUTLIER Glycine 0 CA--C 1.53 1.008 0 C-N-CA 125.29 1.424 . . . . 0.0 112.83 -167.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -142.64 0.8 1.29 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.724 1.609 . . . . 0.0 114.495 -177.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -128.03 150.26 50.01 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 119.593 1.088 . . . . 0.0 113.065 -177.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 45.0 t -77.85 134.58 37.93 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.761 1.624 . . . . 0.0 112.964 -175.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -141.62 165.88 26.28 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 127.982 2.513 . . . . 0.0 109.709 165.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.9 m -114.52 153.94 29.12 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 114.442 1.275 . . . . 0.0 114.442 -175.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.3 m -145.92 164.71 23.94 Favored Pre-proline 0 N--CA 1.485 1.309 0 C-N-CA 127.646 2.379 . . . . 0.0 111.665 -177.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -66.78 153.25 78.6 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.741 2.294 . . . . 0.0 113.077 172.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 . . . . . 0 C--O 1.25 1.084 0 C-N-CA 126.537 1.935 . . . . 0.0 113.255 177.443 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.949 0 N-CA-C 112.266 -0.334 . . . . 0.0 112.266 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.5 t -148.43 176.83 9.97 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.838 0.855 . . . . 0.0 112.418 179.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 51.43 39.47 24.49 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 127.971 2.508 . . . . 0.0 115.424 176.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -139.59 32.38 2.05 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.634 1.174 . . . . 0.0 113.347 -177.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -87.9 -140.9 0.11 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 127.465 2.306 . . . . 0.0 113.579 -176.409 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 61.74 120.38 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 130.461 3.504 . . . . 0.0 113.949 -171.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 61.7 tp -49.38 -41.85 40.41 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.597 1.159 . . . . 0.0 111.904 172.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.31 -33.62 76.41 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 -176.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 60.1 ttt180 -78.62 -43.08 27.16 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 126.546 1.938 . . . . 0.0 111.125 175.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 25.1 t -71.07 -41.05 71.2 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 127.353 2.261 . . . . 0.0 112.087 -173.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -53.95 -45.28 71.24 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 119.239 0.927 . . . . 0.0 112.773 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.01 -35.24 61.99 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.781 1.232 . . . . 0.0 111.937 -178.079 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 69.2 m -71.72 -35.82 70.3 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.446 0.698 . . . . 0.0 112.755 173.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 81.1 m -71.52 -27.75 63.41 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 119.485 1.038 . . . . 0.0 113.145 172.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.36 -38.72 66.39 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.323 1.049 . . . . 0.0 113.755 -176.022 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 88.5 p -69.04 -11.85 61.16 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 -175.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.1 mt -108.23 1.74 22.27 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.203 1.401 . . . . 0.0 112.1 174.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.14 17.83 35.98 Favored Glycine 0 CA--C 1.535 1.283 0 C-N-CA 126.08 1.8 . . . . 0.0 116.372 170.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -136.76 -175.05 3.89 Favored 'General case' 0 CA--C 1.551 0.987 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 -171.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 70.1 mt -92.83 156.73 16.79 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 126.505 1.922 . . . . 0.0 111.148 -176.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -112.93 150.61 18.41 Favored Glycine 0 N--CA 1.472 1.058 0 C-N-CA 124.247 0.927 . . . . 0.0 114.311 176.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -142.76 154.54 44.35 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 127.956 2.502 . . . . 0.0 111.978 170.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -118.83 120.7 38.1 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.144 1.778 . . . . 0.0 111.452 -177.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.5 mp -141.93 128.33 19.2 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 125.627 1.571 . . . . 0.0 109.722 -177.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.94 44.07 94.64 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 124.396 0.998 . . . . 0.0 114.499 170.093 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.264 4.2 mm-40 62.42 20.54 11.95 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 126.535 1.934 . . . . 0.0 115.273 -175.359 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -131.75 142.9 49.9 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.603 -1.31 . . . . 0.0 113.055 173.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 10.2 t -76.84 134.39 39.06 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.805 1.242 . . . . 0.0 111.141 165.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.1 ttpt -138.83 138.4 37.48 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.641 1.176 . . . . 0.0 110.45 167.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.0 m -96.39 144.49 26.48 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.675 0.79 . . . . 0.0 112.083 -172.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.0 m -128.32 151.95 77.25 Favored Pre-proline 0 N--CA 1.473 0.683 0 C-N-CA 126.576 1.95 . . . . 0.0 112.093 -170.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.79 151.32 57.2 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.02 2.48 . . . . 0.0 112.625 -176.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 . . . . . 0 C--O 1.251 1.156 0 C-N-CA 124.119 0.967 . . . . 0.0 110.417 165.398 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.15 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.0 p -67.86 -30.27 69.6 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 122.02 -0.694 . . . . 0.0 111.671 170.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -122.49 -167.0 1.5 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.738 2.015 . . . . 0.0 109.387 161.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 22.0 p90 -139.31 158.91 43.34 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 127.063 2.145 . . . . 0.0 108.988 177.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.4 t -70.56 107.18 3.76 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 122.87 1.319 . . . . 0.0 111.715 172.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -136.93 113.72 10.37 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 105.876 -1.898 . . . . 0.0 105.876 145.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 51.6 tp -57.53 -37.17 72.6 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.399 -0.81 . . . . 0.0 111.814 -176.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.61 -47.84 58.1 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.503 1.047 . . . . 0.0 112.663 -179.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.84 -43.31 76.9 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.195 1.398 . . . . 0.0 111.669 176.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.7 t -72.81 -50.94 21.03 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 126.959 2.103 . . . . 0.0 110.693 -178.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -53.32 -49.63 66.65 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.944 0.898 . . . . 0.0 111.457 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 87.4 mt -74.46 -34.31 63.12 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.476 1.11 . . . . 0.0 113.27 -175.101 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 37.7 m -66.82 -45.96 76.64 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.002 0.521 . . . . 0.0 110.659 170.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 73.0 m -58.96 -36.61 75.11 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 122.816 0.446 . . . . 0.0 111.599 171.214 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -34.43 71.85 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 120.623 -1.298 . . . . 0.0 113.422 175.663 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.8 p -66.11 -15.03 62.74 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 174.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.5 mt -102.59 -9.49 20.09 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.509 1.123 . . . . 0.0 112.023 170.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 120.42 -9.81 10.82 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 126.782 2.134 . . . . 0.0 116.354 172.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -125.59 -173.14 2.76 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 115.76 1.763 . . . . 0.0 115.76 -159.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 79.3 mt -94.01 161.69 14.19 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.222 1.409 . . . . 0.0 111.856 -175.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -118.12 137.6 13.2 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 125.343 1.449 . . . . 0.0 113.116 173.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.7 mptt -134.07 134.86 42.82 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 127.21 2.204 . . . . 0.0 110.66 174.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 29.1 m -75.08 151.68 38.63 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 121.745 0.783 . . . . 0.0 112.261 175.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 30.3 mt -123.83 75.63 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 126.445 1.898 . . . . 0.0 107.556 174.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.15 -96.61 0.14 Allowed Glycine 0 CA--C 1.531 1.07 0 CA-C-N 114.337 -1.301 . . . . 0.0 112.193 -170.722 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -98.5 -0.22 43.79 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.374 1.47 . . . . 0.0 114.578 -179.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -111.76 168.13 9.81 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 127.687 2.395 . . . . 0.0 111.071 177.718 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 9.2 t -146.13 138.11 25.08 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 120.704 -1.247 . . . . 0.0 114.231 167.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 33.7 mmtm -139.06 163.07 33.37 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 126.235 1.814 . . . . 0.0 110.861 -174.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 7.5 m -89.09 156.74 18.64 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -177.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.4 m -148.58 152.23 37.64 Favored Pre-proline 0 N--CA 1.466 0.359 0 C-N-CA 126.218 1.807 . . . . 0.0 111.92 -176.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -73.07 165.69 32.06 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.39 2.727 . . . . 0.0 112.273 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 . . . . . 0 C--O 1.249 1.068 0 C-N-CA 126.217 1.807 . . . . 0.0 112.272 -178.931 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.579 0 N-CA-C 110.027 -1.229 . . . . 0.0 110.027 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.4 p -129.01 -20.22 3.48 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.205 1.402 . . . . 0.0 113.638 178.18 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -123.16 -0.42 8.88 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 115.998 1.851 . . . . 0.0 115.998 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 40.93 68.04 0.46 Allowed 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 127.372 2.269 . . . . 0.0 113.102 168.031 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.1 t -65.21 119.14 10.33 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -154.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -107.33 122.58 46.87 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.24 149.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 65.4 tp -64.15 -37.64 88.2 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 117.891 -1.052 . . . . 0.0 112.999 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.39 -46.12 90.06 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 120.208 1.367 . . . . 0.0 111.542 178.209 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -65.85 -39.7 91.0 Favored 'General case' 0 C--N 1.346 0.441 0 C-N-CA 125.076 1.351 . . . . 0.0 112.841 173.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 19.7 t -63.13 -48.26 79.27 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 124.988 1.315 . . . . 0.0 110.124 178.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -59.88 -47.52 85.42 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.778 0.831 . . . . 0.0 111.104 175.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 51.4 mt -61.1 -44.48 97.29 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.968 0.804 . . . . 0.0 112.555 177.008 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 58.7 m -72.51 -41.03 66.38 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.163 0.985 . . . . 0.0 112.367 -178.224 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 77.0 m -64.33 -39.13 93.29 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.109 0.868 . . . . 0.0 110.992 172.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.1 ttm105 -67.02 -28.73 68.47 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.074 -1.016 . . . . 0.0 113.106 178.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 61.8 m -64.3 -11.14 28.93 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.614 1.339 . . . . 0.0 114.614 168.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.13 2.17 16.61 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 125.251 1.42 . . . . 0.0 112.18 170.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 90.94 18.37 47.51 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 126.074 1.797 . . . . 0.0 116.161 173.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -136.56 178.24 7.22 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 119.119 1.459 . . . . 0.0 114.344 -176.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -94.0 134.06 36.81 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.38 1.872 . . . . 0.0 111.718 -162.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -91.83 132.05 11.08 Favored Glycine 0 CA--C 1.532 1.114 0 CA-C-N 118.491 0.587 . . . . 0.0 113.821 179.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.5 tppt? -123.9 139.14 54.26 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 126.59 1.956 . . . . 0.0 111.56 176.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 7.1 t -105.6 125.63 51.21 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.989 0.915 . . . . 0.0 110.367 175.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.0 mt -118.51 82.79 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 125.302 1.441 . . . . 0.0 108.258 -177.016 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.57 -93.82 0.03 OUTLIER Glycine 0 CA--C 1.532 1.152 0 C-N-CA 125.229 1.395 . . . . 0.0 111.798 -167.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -96.49 -10.49 27.29 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.165 1.786 . . . . 0.0 114.819 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -105.0 147.6 27.62 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 120.52 1.509 . . . . 0.0 114.463 -175.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.4 t -106.52 121.33 44.08 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 124.817 1.247 . . . . 0.0 110.22 171.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -125.87 147.84 49.35 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 126.01 1.724 . . . . 0.0 109.971 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 6.9 m -107.49 143.69 35.5 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 122.792 0.437 . . . . 0.0 111.915 173.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.6 m -135.21 149.05 68.91 Favored Pre-proline 0 N--CA 1.474 0.769 0 C-N-CA 125.18 1.392 . . . . 0.0 112.603 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -82.84 58.74 6.51 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 124.468 3.446 . . . . 0.0 112.656 -170.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 . . . . . 0 C--O 1.252 1.199 0 C-N-CA 127.642 2.377 . . . . 0.0 114.171 -179.44 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.884 0 N-CA-C 110.837 -0.905 . . . . 0.0 110.837 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.5 m -80.25 0.84 30.92 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.545 1.538 . . . . 0.0 114.722 -169.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -134.7 11.73 3.71 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 114.071 1.138 . . . . 0.0 114.071 174.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -44.29 107.0 0.08 Allowed 'General case' 0 C--O 1.234 0.273 0 C-N-CA 129.237 3.015 . . . . 0.0 112.754 -176.066 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 50.8 t -62.92 124.22 20.52 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 113.878 -1.51 . . . . 0.0 114.752 -157.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -121.46 107.63 12.68 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.153 1.381 . . . . 0.0 107.583 153.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 41.8 tp -63.65 -33.21 75.11 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 118.232 -0.889 . . . . 0.0 112.657 -175.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -67.27 -44.66 78.77 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 119.52 1.055 . . . . 0.0 112.795 177.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -77.49 -29.91 52.79 Favored 'General case' 0 C--N 1.344 0.353 0 C-N-CA 124.148 0.979 . . . . 0.0 113.447 178.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.8 t -68.07 -44.26 76.73 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 124.965 1.306 . . . . 0.0 110.121 170.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -57.54 -47.35 82.24 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.879 0.763 . . . . 0.0 110.931 171.19 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.6 tt -57.32 -46.14 83.51 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.832 0.853 . . . . 0.0 111.239 176.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 48.8 m -70.35 -47.63 60.11 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.519 1.127 . . . . 0.0 112.82 -178.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 70.7 m -63.4 -42.88 98.8 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 118.639 0.654 . . . . 0.0 111.179 175.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.5 ttm-85 -74.2 -22.07 59.54 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.745 -1.222 . . . . 0.0 112.651 -177.078 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.8 m -72.19 -16.69 61.97 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 167.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.1 mt -89.53 -30.17 18.41 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.271 0.941 . . . . 0.0 111.333 163.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 128.28 12.88 2.73 Favored Glycine 0 CA--C 1.536 1.372 0 C-N-CA 125.672 1.606 . . . . 0.0 115.744 173.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -135.4 173.57 11.57 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 119.609 1.704 . . . . 0.0 114.595 -172.392 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.8 tp -84.87 135.85 33.9 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.379 1.471 . . . . 0.0 111.544 -167.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.58 137.99 15.86 Favored Glycine 0 CA--C 1.538 1.494 0 CA-C-N 118.725 0.693 . . . . 0.0 113.299 170.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.11 128.21 22.3 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.014 1.726 . . . . 0.0 113.878 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 6.7 t -91.63 133.42 35.58 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.265 1.426 . . . . 0.0 111.587 -179.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 13.1 mt -138.98 112.97 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.751 1.221 . . . . 0.0 110.396 -175.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.11 -100.76 0.43 Allowed Glycine 0 CA--C 1.53 1.017 0 N-CA-C 110.558 -1.017 . . . . 0.0 110.558 -168.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -126.99 7.95 6.69 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 126.671 1.988 . . . . 0.0 113.965 176.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -123.61 150.14 44.49 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.707 1.203 . . . . 0.0 110.258 -178.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.1 t -105.44 145.98 30.12 Favored 'General case' 0 CA--C 1.537 0.481 0 O-C-N 121.372 -0.83 . . . . 0.0 112.581 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -122.16 163.42 19.56 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 128.193 2.597 . . . . 0.0 109.839 174.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.9 m -106.34 149.18 27.21 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 122.056 -0.403 . . . . 0.0 111.598 163.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.2 m -142.4 156.09 64.03 Favored Pre-proline 0 N--CA 1.479 0.995 0 C-N-CA 124.999 1.32 . . . . 0.0 113.714 -172.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -84.5 51.55 3.3 Favored 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 124.987 3.791 . . . . 0.0 113.056 -172.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 . . . . . 0 C--O 1.252 1.229 0 C-N-CA 126.577 1.951 . . . . 0.0 113.604 -178.062 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.769 0 N-CA-C 110.348 -1.101 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.5 m 54.41 32.75 17.16 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.788 1.635 . . . . 0.0 115.253 -179.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.75 59.16 2.47 Favored 'General case' 0 CA--C 1.553 1.077 0 O-C-N 120.841 -1.162 . . . . 0.0 113.021 177.606 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 1.2 t80 47.08 86.21 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 128.456 2.703 . . . . 0.0 116.484 167.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 9.4 t -63.87 129.43 40.06 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.15 1.38 . . . . 0.0 111.913 165.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -175.67 116.95 0.15 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 127.437 2.295 . . . . 0.0 106.697 167.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 29.7 tp -59.22 -40.86 87.18 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.754 1.161 . . . . 0.0 112.438 -173.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.7 -48.49 81.54 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 119.488 1.04 . . . . 0.0 112.433 178.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -60.07 -43.42 95.47 Favored 'General case' 0 C--N 1.346 0.432 0 C-N-CA 125.645 1.578 . . . . 0.0 112.832 172.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 7.9 t -77.38 -43.38 32.96 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 124.986 1.314 . . . . 0.0 111.44 -169.58 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -58.72 -44.49 90.43 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.823 1.192 . . . . 0.0 111.162 171.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 79.1 mt -64.55 -38.5 91.22 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 175.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 63.0 m -79.1 -32.38 44.6 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.763 1.225 . . . . 0.0 113.116 -179.24 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 58.6 m -73.33 -27.29 61.44 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 119.009 -0.519 . . . . 0.0 111.129 169.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -35.79 75.33 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 119.836 1.198 . . . . 0.0 112.944 167.658 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.7 m -63.51 -19.94 65.19 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.222 1.009 . . . . 0.0 113.083 174.632 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 21.0 mt -100.2 -27.24 13.62 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.28 1.432 . . . . 0.0 112.349 172.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 105.33 17.97 12.83 Favored Glycine 0 CA--C 1.539 1.59 0 C-N-CA 126.199 1.857 . . . . 0.0 115.911 178.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -134.56 -177.56 4.66 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.382 1.591 . . . . 0.0 113.13 -175.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 30.3 tp -91.27 140.83 29.42 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.121 1.768 . . . . 0.0 112.706 -165.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -92.14 141.71 15.72 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 124.817 1.199 . . . . 0.0 115.938 -178.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.3 tppt? -143.53 173.62 11.48 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 128.054 2.542 . . . . 0.0 112.927 176.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 35.8 t -126.2 144.73 50.66 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.526 1.53 . . . . 0.0 110.864 174.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 55.6 mt -135.54 118.16 22.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 124.288 1.035 . . . . 0.0 108.348 166.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.23 -79.92 0.63 Allowed Glycine 0 N--CA 1.472 1.055 0 C-N-CA 124.327 0.965 . . . . 0.0 114.412 171.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -150.83 18.42 0.79 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 127.833 2.453 . . . . 0.0 112.003 176.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -120.45 145.37 47.31 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.429 2.292 . . . . 0.0 112.663 -177.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 2.1 t -83.88 132.36 34.8 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 124.946 1.298 . . . . 0.0 110.06 169.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -136.31 131.4 34.3 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.75 1.22 . . . . 0.0 110.319 -177.594 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 6.3 m -99.19 144.27 28.51 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.182 0.593 . . . . 0.0 111.796 177.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.0 m -134.65 155.19 79.72 Favored Pre-proline 0 N--CA 1.474 0.756 0 C-N-CA 125.921 1.689 . . . . 0.0 112.702 -177.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -71.38 161.99 43.81 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.719 2.946 . . . . 0.0 112.659 174.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 83.7 m-85 . . . . . 0 C--O 1.251 1.143 0 C-N-CA 125.421 1.488 . . . . 0.0 114.065 -176.238 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.166 0 N-CA-C 111.191 -0.764 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.6 p -62.02 -26.21 68.1 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 126.928 2.091 . . . . 0.0 115.594 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -121.26 -16.82 7.84 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -170.385 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 18.4 t80 67.26 130.1 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 128.531 2.732 . . . . 0.0 117.071 167.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.5 t -78.4 93.94 4.8 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 120.633 -1.292 . . . . 0.0 112.977 176.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 55.2 t-20 -151.57 111.94 4.15 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.049 1.34 . . . . 0.0 109.544 161.245 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 42.3 tp -52.26 -41.12 62.55 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.071 0.948 . . . . 0.0 112.647 177.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.25 90.27 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 118.939 0.79 . . . . 0.0 112.91 -177.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 59.7 ttt180 -71.42 -43.21 67.18 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.701 1.6 . . . . 0.0 111.401 174.277 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 19.7 t -68.46 -40.06 81.19 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 126.442 1.897 . . . . 0.0 112.007 -176.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -60.05 -44.11 94.9 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.802 0.728 . . . . 0.0 112.299 178.379 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -74.16 -33.98 63.68 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.75 0.82 . . . . 0.0 112.448 177.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 28.4 m -65.49 -47.28 76.59 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 121.601 -0.687 . . . . 0.0 111.87 172.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.2 m -70.81 -34.54 71.84 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 118.735 0.698 . . . . 0.0 112.594 177.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 41.9 ttm180 -54.91 -34.35 63.04 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 121.289 -0.882 . . . . 0.0 111.161 168.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.3 m -77.54 0.58 22.4 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 176.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.2 mt -115.92 -3.83 12.12 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 125.278 1.431 . . . . 0.0 112.075 165.119 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.43 19.02 31.23 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 125.733 1.635 . . . . 0.0 116.383 175.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -143.78 -172.05 3.66 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.367 1.467 . . . . 0.0 112.89 -179.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 20.5 tp -94.25 150.77 19.99 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.461 1.504 . . . . 0.0 111.901 -168.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -106.04 142.81 15.65 Favored Glycine 0 CA--C 1.532 1.113 0 O-C-N 121.424 -0.797 . . . . 0.0 114.523 177.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -142.64 160.94 39.32 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 128.031 2.532 . . . . 0.0 111.036 169.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 4.7 t -97.44 138.09 35.42 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.762 -0.586 . . . . 0.0 111.387 167.006 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 55.1 mt -126.49 116.04 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 125.358 1.463 . . . . 0.0 108.848 168.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.41 -96.65 0.15 Allowed Glycine 0 CA--C 1.532 1.127 0 C-N-CA 125.064 1.316 . . . . 0.0 112.453 -176.101 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -125.33 18.89 8.23 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 125.956 1.702 . . . . 0.0 113.62 178.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -129.61 145.27 51.5 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.295 1.438 . . . . 0.0 112.861 -174.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 9.6 t -74.95 128.11 34.79 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.231 0.613 . . . . 0.0 109.84 160.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -130.45 132.7 45.83 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.306 1.442 . . . . 0.0 108.776 174.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 22.5 m -92.84 139.7 30.27 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 120.787 0.327 . . . . 0.0 111.687 -177.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.7 m -127.34 152.69 76.61 Favored Pre-proline 0 N--CA 1.469 0.517 0 C-N-CA 126.011 1.725 . . . . 0.0 110.984 -168.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -63.24 158.93 41.83 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.287 2.658 . . . . 0.0 112.365 -177.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 . . . . . 0 C--O 1.253 1.262 0 C-N-CA 124.576 1.151 . . . . 0.0 109.765 159.591 . . . . . . . . 0 0 . 1 stop_ save_