data_5kph_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 5kph _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' ' ' GLU . . . . . 0.557 ' HA ' ' HD3' ' A' ' 9' ' ' ARG . 34.0 tt0 . . . . . 0 N--CA 1.47 0.555 0 N-CA-C 110.816 -0.068 . . . . 75.24 110.816 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.403 ' O ' HG23 ' A' ' 11' ' ' VAL . 30.2 mm-40 -64.83 -38.2 90.19 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 119.316 -0.373 . . . . 55.21 110.819 178.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -59.78 -45.94 90.74 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 109.503 -0.555 . . . . 65.21 109.503 174.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.557 ' HD3' ' HA ' ' A' ' 6' ' ' GLU . 74.4 mtp180 -54.36 -42.12 69.94 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 124.144 0.902 . . . . 72.05 111.082 -178.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -70.84 -52.62 19.19 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.754 0.821 . . . . 74.1 111.306 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.608 HG22 HD13 ' A' ' 40' ' ' ILE . 96.3 t -64.79 -44.99 96.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 124.015 0.926 . . . . 74.12 112.15 -171.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -68.28 -31.63 71.23 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 123.77 0.669 . . . . 71.44 110.704 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.475 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 8.9 tt0 -69.51 -46.35 66.76 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 123.753 0.658 . . . . 74.21 110.033 176.122 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.479 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 68.8 t -58.67 -45.24 90.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 123.032 0.533 . . . . 75.04 109.631 175.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.441 ' HB1' HD12 ' A' ' 44' ' ' LEU . . . -60.61 -48.43 81.8 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.614 1.165 . . . . 71.02 111.741 -176.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -67.74 -42.56 81.67 Favored 'General case' 0 C--N 1.351 0.639 0 O-C-N 123.63 0.581 . . . . 75.21 110.47 -178.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 63.3 mm-40 -63.64 -34.67 78.37 Favored 'General case' 0 C--N 1.357 0.932 0 O-C-N 123.62 0.575 . . . . 75.41 111.023 -177.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.479 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 65.9 mmtt -64.05 -40.93 97.38 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 123.654 0.596 . . . . 72.44 111.067 176.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.545 HD11 HG13 ' A' ' 28' ' ' VAL . 64.7 mt -70.41 -29.71 66.4 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 116.088 -0.506 . . . . 74.31 111.288 176.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 89.7 mt -77.65 -23.67 49.65 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.835 0.854 . . . . 65.44 110.556 175.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -74.04 -39.51 63.48 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.43 0.692 . . . . 75.35 109.543 172.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -73.38 -31.12 63.73 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 115.784 -0.643 . . . . 74.12 111.426 178.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.8 t -153.65 87.97 3.69 Favored Pre-proline 0 CA--C 1.56 1.362 0 C-N-CA 122.496 0.318 . . . . 54.43 110.307 -176.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -68.03 -17.13 45.96 Favored 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 123.658 2.905 . . . . 74.43 114.812 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -79.81 -17.46 53.29 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-O 121.03 0.443 . . . . 64.33 111.062 178.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 37.1 m -91.65 147.98 22.6 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.683 0.793 . . . . 73.41 111.443 -177.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -109.39 118.78 37.56 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 108.655 -0.868 . . . . 73.12 108.655 172.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.545 HG13 HD11 ' A' ' 19' ' ' LEU . 36.6 t -100.26 144.05 13.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 C-N-CA 124.02 0.928 . . . . 74.14 110.265 -175.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -132.58 147.96 52.36 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.342 1.057 . . . . 73.12 108.488 172.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 57.6 t -67.16 137.04 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.125 0.57 . . . . 75.22 109.975 177.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.8 tpt85 -115.7 -39.34 3.53 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.374 0.269 . . . . 74.51 110.965 -173.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.58 ' HB3' ' HB2' ' A' ' 43' ' ' GLU . 0.1 OUTLIER -167.8 144.46 4.17 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 108.551 -0.907 . . . . 74.01 108.551 -174.208 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.526 HG21 HG11 ' A' ' 42' ' ' VAL . 89.8 t -135.08 139.29 47.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 N-CA-C 108.838 -0.801 . . . . 74.45 108.838 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -135.35 113.69 11.47 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.902 0.881 . . . . 73.21 110.711 177.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.482 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 23.9 tptm -81.31 107.7 14.31 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 108.65 -0.871 . . . . 75.11 108.65 172.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -121.93 81.96 1.89 Allowed 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 108.681 -0.859 . . . . 71.24 108.681 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.482 ' O ' ' HE2' ' A' ' 35' ' ' LYS . . . 63.91 -125.65 32.98 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 111.521 -0.632 . . . . 44.12 111.521 -173.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -70.91 -30.47 66.81 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-N 117.524 0.662 . . . . 74.45 111.2 174.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 24.7 m -94.81 110.21 22.1 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 123.245 0.618 . . . . 73.43 111.798 -169.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.608 HD13 HG22 ' A' ' 11' ' ' VAL . 41.1 mt -95.57 113.5 30.1 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 123.799 0.84 . . . . 75.11 110.479 174.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 24.8 mtp-105 -87.88 101.56 13.85 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.286 0.634 . . . . 71.33 109.295 173.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.526 HG11 HG21 ' A' ' 33' ' ' VAL . 48.9 t -97.85 108.36 21.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 N-CA-C 108.763 -0.829 . . . . 73.41 108.763 176.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.58 ' HB2' ' HB3' ' A' ' 32' ' ' ARG . 51.9 mp0 -75.0 129.29 37.39 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 108.867 -0.79 . . . . 71.12 108.867 165.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.441 HD12 ' HB1' ' A' ' 15' ' ' ALA . 3.5 mp -122.72 168.29 12.4 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.878 -0.786 . . . . 72.14 108.878 172.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -126.41 108.63 11.39 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.297 -1.001 . . . . 74.4 108.297 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.416 HD11 ' HB3' ' A' ' 19' ' ' LEU . 6.8 tt -95.92 119.32 34.2 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.377 1.071 . . . . 75.41 108.112 -177.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 84.9 mtm180 . . . . . 0 N--CA 1.479 0.989 0 C-N-CA 123.498 0.719 . . . . 74.23 109.914 -174.929 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt . . . . . 0 CA--C 1.534 0.352 0 N-CA-C 107.223 -1.399 . . . . 75.42 107.223 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -104.48 114.82 29.31 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.222 0.609 . . . . 70.24 109.556 -174.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -75.39 117.98 17.78 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.645 -0.872 . . . . 65.14 108.645 171.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -105.92 170.46 7.89 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.646 0.778 . . . . 74.22 109.716 177.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 26.8 m -145.09 102.16 3.71 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 108.028 -1.101 . . . . 75.12 108.028 173.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.428 HG13 ' HA ' ' A' ' 15' ' ' ALA . 61.1 t -93.0 102.92 14.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 N-CA-C 107.019 -1.474 . . . . 71.13 107.019 178.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -89.19 105.3 17.7 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 114.298 -1.319 . . . . 71.14 108.14 -177.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.401 HG13 ' HB3' ' A' ' 66' ' ' TRP . 45.4 t -100.04 152.26 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 125.041 1.337 . . . . 73.54 109.52 -176.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -130.0 144.99 51.63 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.133 0.973 . . . . 75.33 110.207 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.8 tpt180 -81.33 113.04 19.16 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.774 0.83 . . . . 75.31 109.566 175.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 -120.42 100.63 7.27 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 107.998 -1.112 . . . . 74.43 107.998 170.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 72.49 -112.19 3.89 Favored Glycine 0 C--N 1.348 1.2 0 N-CA-C 111.368 -0.693 . . . . 54.33 111.368 -175.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -106.54 -16.13 14.61 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.571 0.748 . . . . 73.5 110.572 174.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 42.2 p -93.37 149.23 21.39 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 122.993 0.517 . . . . 75.35 111.166 -172.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . 0.401 ' HB3' HG13 ' A' ' 59' ' ' VAL . 99.1 m95 -103.25 116.22 32.04 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.226 1.01 . . . . 75.05 109.905 179.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.1 t -108.49 145.22 35.04 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.762 0.825 . . . . 54.45 110.435 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.453 HG23 ' HG3' ' A' ' 18' ' ' LYS . 88.7 t -86.23 113.02 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 O-C-N 121.856 -0.527 . . . . 73.11 109.908 179.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.465 ' HZ2' ' HB3' ' A' ' 69' ' ' LYS . 3.5 mmmp? -66.1 -47.47 74.09 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.913 0.885 . . . . 75.32 110.603 173.488 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -161.95 154.29 19.59 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.501 -0.772 . . . . 71.33 110.75 -178.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.445 HD13 ' HB3' ' A' ' 18' ' ' LYS . 80.3 mt -113.57 107.24 22.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 107.119 -1.438 . . . . 64.54 107.119 166.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 27.6 m -92.28 144.18 25.65 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.662 0.785 . . . . 72.32 109.063 178.112 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -116.18 148.48 40.32 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 107.21 -1.404 . . . . 74.51 107.21 170.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.1 t . . . . . 0 CA--C 1.549 0.929 0 C-N-CA 123.452 0.701 . . . . 72.41 109.902 174.355 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 . . . . . 0 N--CA 1.474 0.743 0 N-CA-C 110.662 -0.125 . . . . 73.41 110.662 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.529 ' O ' HG21 ' A' ' 11' ' ' VAL . 67.8 mm-40 -59.06 -47.31 85.69 Favored 'General case' 0 C--N 1.356 0.875 0 CA-C-O 118.745 -0.645 . . . . 73.2 110.696 -178.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.72 -35.46 72.71 Favored 'General case' 0 C--N 1.364 1.199 0 O-C-N 123.671 0.607 . . . . 72.21 111.022 177.279 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 20.9 mtm180 -65.55 -32.82 74.62 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 122.627 0.371 . . . . 73.42 110.902 178.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -74.36 -38.48 63.19 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 122.99 0.516 . . . . 75.15 110.555 174.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.611 HG23 HD12 ' A' ' 40' ' ' ILE . 58.5 t -70.11 -44.29 78.28 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 C-N-CA 123.493 0.717 . . . . 65.14 111.288 -176.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.458 ' HD3' HG21 ' A' ' 33' ' ' VAL . 45.7 mtmt -63.03 -37.35 86.82 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.911 0.884 . . . . 72.13 110.02 177.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.443 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.3 tt0 -63.28 -55.65 22.98 Favored 'General case' 0 C--N 1.353 0.729 0 O-C-N 124.408 1.067 . . . . 74.12 110.072 177.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.523 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 95.8 t -55.84 -44.24 76.99 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 O-C-N 123.515 0.51 . . . . 72.04 109.941 178.468 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.44 ' HA ' HG12 ' A' ' 57' ' ' VAL . . . -60.24 -45.78 92.07 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 124.561 1.144 . . . . 62.24 112.156 -177.647 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -74.47 -31.98 62.42 Favored 'General case' 0 C--N 1.349 0.582 0 CA-C-N 116.02 -0.536 . . . . 74.42 110.68 -177.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.445 ' O ' ' HG3' ' A' ' 21' ' ' GLU . 7.3 mm-40 -64.81 -38.39 90.82 Favored 'General case' 0 C--N 1.352 0.692 0 O-C-N 123.807 0.692 . . . . 75.31 110.014 176.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 29.0 mmmt -58.94 -49.89 76.14 Favored 'General case' 0 C--N 1.362 1.124 0 O-C-N 123.72 0.637 . . . . 74.42 110.617 176.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.633 ' HB3' HD11 ' A' ' 46' ' ' LEU . 53.1 mt -66.29 -29.26 69.44 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.227 -0.897 . . . . 75.44 112.194 -179.101 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.9 mt -78.86 -27.5 44.08 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.219 0.607 . . . . 75.22 111.078 176.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.445 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 52.7 mt-10 -70.94 -42.87 69.25 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 109.719 -0.474 . . . . 63.43 109.719 174.282 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.428 ' NE2' HD21 ' A' ' 19' ' ' LEU . 47.4 mt-30 -68.64 -41.85 78.83 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 115.168 -0.924 . . . . 74.23 111.001 178.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.2 t -145.58 91.51 5.72 Favored Pre-proline 0 CA--C 1.552 1.054 0 CA-C-N 115.662 -0.699 . . . . 73.21 109.453 -177.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -79.63 -2.85 12.52 Favored 'Trans proline' 0 C--N 1.378 2.102 0 C-N-CA 122.927 2.418 . . . . 71.44 112.15 174.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -95.26 13.93 23.96 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.399 1.08 . . . . 74.32 110.673 -178.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 60.1 p -135.21 148.87 49.77 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.048 0.539 . . . . 75.42 110.871 -175.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.406 ' HE2' ' HA ' ' A' ' 27' ' ' LYS . 11.1 mmpt? -90.3 114.63 26.73 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-O 121.256 0.551 . . . . 74.44 109.925 175.215 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 87.5 t -99.86 124.69 53.43 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 CA-C-N 114.29 -1.323 . . . . 74.42 109.252 -178.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -112.85 167.06 10.81 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.225 1.41 . . . . 64.24 108.157 174.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.403 HG23 ' HB3' ' A' ' 12' ' ' LYS . 87.6 t -104.96 110.92 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 N-CA-C 107.929 -1.137 . . . . 54.14 107.929 169.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -81.89 -43.82 17.65 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 122.767 0.427 . . . . 74.41 111.379 -171.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -162.78 146.21 11.14 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 108.168 -1.049 . . . . 74.41 108.168 -176.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.53 HG12 HG23 ' A' ' 42' ' ' VAL . 40.0 t -118.34 141.22 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 N-CA-C 108.892 -0.781 . . . . 74.32 108.892 177.175 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -135.83 112.74 10.28 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 122.988 0.515 . . . . 73.02 110.241 177.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.2 tmtp? -86.11 117.48 24.97 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 108.349 -0.982 . . . . 75.4 108.349 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -129.23 75.89 1.68 Allowed 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.464 0.706 . . . . 74.21 110.083 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 67.27 -96.99 0.35 Allowed Glycine 0 C--N 1.35 1.335 0 CA-C-N 115.274 -0.875 . . . . 74.31 113.971 173.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.685 ' HB3' ' HG3' ' A' ' 60' ' ' GLU . 16.7 m120 -80.24 -52.58 7.56 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 109.254 -0.647 . . . . 63.12 109.254 173.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 19.8 m -94.84 110.3 22.19 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 114.919 -1.037 . . . . 74.25 110.601 -168.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.611 HD12 HG23 ' A' ' 11' ' ' VAL . 41.9 mt -87.86 107.99 17.99 Favored 'Isoleucine or valine' 0 C--O 1.24 0.568 0 N-CA-C 108.541 -0.911 . . . . 73.3 108.541 169.563 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.563 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 86.8 mtt180 -82.97 96.54 8.35 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 109.0 -0.741 . . . . 74.12 109.0 174.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.53 HG23 HG12 ' A' ' 33' ' ' VAL . 40.7 t -88.29 114.11 26.31 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 107.832 -1.173 . . . . 74.05 107.832 174.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -85.94 107.16 17.6 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.907 0.883 . . . . 74.35 109.411 174.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.2 mp -99.43 170.51 8.57 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.689 0.796 . . . . 74.03 110.761 178.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -130.19 104.04 7.07 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.98 0.912 . . . . 73.11 109.37 -177.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.633 HD11 ' HB3' ' A' ' 19' ' ' LEU . 9.6 tt -104.58 143.96 32.35 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 108.432 -0.951 . . . . 74.52 108.432 -177.052 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 56.1 mtt85 . . . . . 0 N--CA 1.479 0.98 0 C-N-CA 122.923 0.489 . . . . 61.23 110.814 -177.198 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 33.9 ttpt . . . . . 0 CA--C 1.546 0.804 0 N-CA-C 111.734 0.272 . . . . 75.21 111.734 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -118.67 113.01 20.54 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 107.826 -1.176 . . . . 73.43 107.826 170.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -81.21 126.07 31.07 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.241 0.616 . . . . 74.14 110.031 177.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -113.06 118.73 35.6 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.198 0.599 . . . . 73.43 109.706 178.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 30.7 m -86.33 102.7 14.24 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.978 0.911 . . . . 63.13 109.093 174.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.458 HG13 HG12 ' A' ' 71' ' ' ILE . 56.0 t -91.54 105.91 17.06 Favored 'Isoleucine or valine' 0 C--O 1.243 0.733 0 N-CA-C 108.633 -0.877 . . . . 75.41 108.633 179.137 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.563 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 24.7 mt-10 -83.84 102.04 12.07 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 125.237 1.415 . . . . 52.32 108.985 -178.015 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.533 HG21 HG21 ' A' ' 68' ' ' VAL . 18.1 t -110.43 123.59 66.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 123.394 0.678 . . . . 71.1 109.373 -177.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.685 ' HG3' ' HB3' ' A' ' 38' ' ' ASN . 39.7 tt0 -102.97 142.97 33.17 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.123 0.969 . . . . 75.42 110.723 -175.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -79.96 111.72 16.57 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 123.584 0.754 . . . . 74.44 109.103 171.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 15.6 mm-40 -116.15 99.26 7.11 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 108.235 -1.024 . . . . 74.15 108.235 171.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.45 -106.07 1.69 Allowed Glycine 0 C--N 1.345 1.053 0 N-CA-C 111.115 -0.794 . . . . 62.44 111.115 -173.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -112.65 -17.57 12.56 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.014 0.926 . . . . 63.14 110.656 174.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 81.0 p -88.36 128.83 35.51 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 122.965 0.506 . . . . 74.45 110.279 -174.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.8 m95 -82.24 131.97 35.23 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.519 0.728 . . . . 73.51 109.287 172.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 8.8 t -132.67 121.12 22.66 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 123.442 0.697 . . . . 73.2 109.785 -175.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.533 HG21 HG21 ' A' ' 59' ' ' VAL . 97.7 t -74.32 104.02 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 123.605 0.762 . . . . 65.52 110.075 -179.244 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -70.0 -50.75 38.43 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.592 0.757 . . . . 74.52 110.754 -177.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 21.4 tpt180 -158.75 147.34 18.5 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.508 -0.769 . . . . 75.15 110.14 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.458 HG12 HG13 ' A' ' 57' ' ' VAL . 65.8 mt -110.55 105.73 19.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 N-CA-C 107.909 -1.145 . . . . 54.43 107.909 172.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 59.9 m -98.93 107.12 19.48 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.786 0.834 . . . . 74.11 110.302 -178.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 30.6 ttp180 -75.01 151.01 38.79 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.516 0.726 . . . . 74.22 110.439 175.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 15.1 t . . . . . 0 CA--C 1.549 0.923 0 C-N-CA 123.399 0.68 . . . . 71.32 109.576 171.709 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 . . . . . 0 N--CA 1.485 1.314 0 CA-C-O 121.16 0.505 . . . . 64.5 111.442 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.527 ' O ' HG23 ' A' ' 11' ' ' VAL . 12.2 pt-20 -59.39 -37.56 78.29 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 115.651 -0.704 . . . . 64.44 110.808 176.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.589 ' HG3' HG11 ' A' ' 33' ' ' VAL . 0.3 OUTLIER -54.84 -39.13 68.26 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 123.627 0.771 . . . . 75.31 111.142 177.925 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.8 mmm180 -62.39 -42.56 99.52 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.708 0.803 . . . . 75.33 109.93 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.423 ' O ' HG21 ' A' ' 14' ' ' VAL . 45.7 mm-40 -66.84 -43.08 84.62 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 114.729 -1.123 . . . . 74.33 110.937 177.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.58 HG22 HD13 ' A' ' 40' ' ' ILE . 63.7 t -67.89 -43.22 86.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 123.854 0.862 . . . . 72.14 111.655 -174.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -63.51 -31.91 73.21 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.029 0.531 . . . . 72.41 110.488 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.437 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 8.7 tt0 -66.71 -52.95 38.74 Favored 'General case' 0 C--N 1.349 0.554 0 O-C-N 123.847 0.717 . . . . 71.1 110.165 174.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.423 HG21 ' O ' ' A' ' 10' ' ' GLN . 66.1 t -59.71 -30.79 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 123.624 0.77 . . . . 74.04 110.804 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.498 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -76.17 -47.12 25.34 Favored 'General case' 0 C--O 1.248 0.992 0 C-N-CA 123.977 0.911 . . . . 73.52 111.992 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -70.59 -33.64 71.29 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 116.054 -0.521 . . . . 71.0 111.514 -172.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 23.1 mm-40 -65.92 -36.99 84.9 Favored 'General case' 0 C--N 1.353 0.753 0 O-C-N 123.789 0.68 . . . . 74.2 110.887 178.791 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.557 ' HG3' HG22 ' A' ' 68' ' ' VAL . 68.4 mmtt -60.66 -42.89 97.94 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 123.613 0.571 . . . . 70.5 111.303 176.502 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 51.4 mt -72.45 -30.23 64.4 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 115.756 -0.656 . . . . 70.13 111.859 178.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 68.8 mt -70.34 -27.38 64.31 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.204 0.602 . . . . 75.44 111.308 174.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 50.5 mt-10 -70.12 -35.05 73.83 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 120.947 0.403 . . . . 73.31 110.479 174.177 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -83.08 -24.98 32.45 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 115.61 -0.723 . . . . 72.03 111.664 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.0 t -158.56 93.61 1.95 Allowed Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 123.448 0.699 . . . . 74.33 109.394 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_endo -82.06 -9.45 11.76 Favored 'Trans proline' 0 C--N 1.373 1.828 0 C-N-CA 123.142 2.561 . . . . 74.11 113.683 -178.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -85.82 -6.18 59.14 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.263 0.625 . . . . 72.44 111.447 -178.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 64.6 p -114.37 140.54 48.57 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.198 0.999 . . . . 75.1 111.078 -175.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -80.15 127.61 32.52 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.903 -0.777 . . . . 75.15 108.903 171.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.557 HG23 HD12 ' A' ' 46' ' ' LEU . 39.6 t -98.71 112.67 31.4 Favored 'Isoleucine or valine' 0 C--O 1.239 0.532 0 O-C-N 123.535 0.522 . . . . 65.52 109.669 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -99.13 172.98 7.04 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.618 0.767 . . . . 71.42 109.394 175.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.7 p -98.3 132.87 42.47 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 N-CA-C 108.923 -0.769 . . . . 73.13 108.923 171.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.8 tpt180 -88.95 -47.44 8.14 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.399 0.68 . . . . 73.25 109.304 173.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.6 mtt180 -165.02 157.78 16.24 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.319 1.048 . . . . 71.14 109.755 175.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.589 HG11 ' HG3' ' A' ' 8' ' ' LYS . 73.0 t -116.49 110.27 30.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 N-CA-C 108.692 -0.855 . . . . 63.51 108.692 175.353 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -100.99 109.8 21.76 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.172 0.589 . . . . 75.13 109.435 -177.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.3 mmtt -79.69 136.29 36.75 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.915 0.886 . . . . 74.44 109.475 178.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -150.6 67.07 0.94 Allowed 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 107.928 -1.138 . . . . 73.13 107.928 -178.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 67.86 -135.24 30.28 Favored Glycine 0 C--N 1.349 1.277 0 CA-C-N 115.293 -0.867 . . . . 75.52 111.857 -173.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -76.45 -1.14 25.64 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.05 0.54 . . . . 72.03 111.856 176.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 55.1 m -99.84 141.66 32.36 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.462 0.705 . . . . 71.12 109.161 169.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.58 HD13 HG22 ' A' ' 11' ' ' VAL . 59.9 mt -129.79 117.4 41.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 C-N-CA 123.477 0.711 . . . . 75.52 109.222 171.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.421 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 9.8 mtp180 -81.91 97.9 8.28 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 108.684 -0.858 . . . . 74.22 108.684 169.031 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.6 t -80.71 114.19 21.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 N-CA-C 107.973 -1.121 . . . . 74.42 107.973 174.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -86.16 117.57 25.07 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 106.632 -1.618 . . . . 54.43 106.632 169.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.0 mp -111.92 169.84 8.56 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.054 0.454 . . . . 63.0 110.117 -179.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -141.58 107.64 5.19 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.696 0.76 . . . . 73.31 109.16 179.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.557 HD12 HG23 ' A' ' 28' ' ' VAL . 3.0 tt -113.21 135.52 53.73 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.522 1.529 . . . . 73.44 108.492 -173.131 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 66.5 mtp180 . . . . . 0 N--CA 1.486 1.358 0 CA-C-N 117.87 0.305 . . . . 73.43 111.463 -178.746 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt . . . . . 0 N--CA 1.471 0.596 0 CA-C-O 121.546 0.688 . . . . 75.31 109.655 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -108.62 125.55 51.99 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 115.332 -0.849 . . . . 75.33 109.872 -175.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -78.72 146.06 34.14 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.199 0.523 . . . . 63.02 109.709 171.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -132.71 171.12 14.29 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.666 0.786 . . . . 74.1 109.507 177.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.685 ' HB ' ' HB ' ' A' ' 72' ' ' THR . 79.3 m -142.23 104.22 4.41 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 108.174 -1.047 . . . . 72.42 108.174 177.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.498 HG11 ' HA ' ' A' ' 15' ' ' ALA . 99.1 t -99.54 104.82 16.56 Favored 'Isoleucine or valine' 0 C--O 1.239 0.545 0 N-CA-C 107.726 -1.213 . . . . 75.33 107.726 174.281 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.421 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 31.5 mt-10 -82.59 100.21 10.01 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 114.007 -1.451 . . . . 70.14 108.618 -177.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.1 t -100.95 151.17 5.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 124.19 0.996 . . . . 74.42 109.132 -177.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -145.31 135.62 24.04 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 108.753 -0.832 . . . . 71.21 108.753 -175.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 31.1 ttp180 -80.29 133.27 35.95 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.152 0.581 . . . . 73.13 111.998 -172.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 64.3 mm-40 -121.08 109.24 14.8 Favored 'General case' 0 C--O 1.242 0.697 0 N-CA-C 107.515 -1.291 . . . . 73.04 107.515 175.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 67.88 -106.13 1.61 Allowed Glycine 0 C--N 1.345 1.029 0 N-CA-C 110.719 -0.953 . . . . 73.33 110.719 -171.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 54.3 t30 -110.41 -27.28 9.11 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.804 0.842 . . . . 73.25 110.022 172.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 33.9 p -77.75 172.52 13.29 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.163 0.585 . . . . 73.13 110.675 -177.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 89.0 m95 -125.76 146.68 49.67 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.376 0.67 . . . . 75.13 110.371 -175.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 6.1 t -137.75 144.07 41.48 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 122.892 0.477 . . . . 74.2 110.092 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.557 HG22 ' HG3' ' A' ' 18' ' ' LYS . 76.3 t -82.96 118.67 31.04 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 123.072 0.549 . . . . 74.5 109.86 177.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -88.62 -30.99 18.8 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 116.096 -0.502 . . . . 75.4 111.509 177.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 65.5 ttt-85 -158.66 137.17 10.94 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 120.527 0.204 . . . . 64.24 111.292 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 73.3 mt -103.02 131.18 51.88 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 N-CA-C 107.975 -1.121 . . . . 73.52 107.975 168.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.685 ' HB ' ' HB ' ' A' ' 56' ' ' THR . 27.8 m -128.1 150.2 50.07 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.203 1.001 . . . . 71.42 108.976 -177.455 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 27.4 ttp180 -126.41 145.37 50.49 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.079 0.952 . . . . 75.34 108.634 175.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.7 t . . . . . 0 CA--C 1.546 0.808 0 CA-C-O 121.111 0.481 . . . . 54.21 110.053 177.088 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 . . . . . 0 CA--C 1.53 0.2 0 N-CA-C 111.495 0.183 . . . . 63.21 111.495 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.526 ' O ' HG22 ' A' ' 11' ' ' VAL . 7.5 mm-40 -52.09 -52.41 51.46 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 124.295 0.997 . . . . 64.2 110.568 178.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.1 -43.2 96.1 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.17 -0.923 . . . . 74.32 109.811 -177.293 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 25.3 mtm180 -59.78 -35.12 73.99 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.6 0.76 . . . . 71.35 111.708 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.45 ' O ' HG22 ' A' ' 14' ' ' VAL . 46.8 mt-30 -75.12 -55.1 6.07 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.406 0.682 . . . . 74.41 110.511 179.085 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.57 HG13 ' HB ' ' A' ' 59' ' ' VAL . 42.8 t -62.73 -46.01 97.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 123.726 0.81 . . . . 74.23 111.766 -170.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -66.42 -33.4 75.63 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.135 0.574 . . . . 53.41 110.882 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -70.76 -44.34 66.94 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 123.603 0.564 . . . . 70.1 110.214 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.478 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 88.9 t -58.05 -50.35 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 N-CA-C 109.051 -0.722 . . . . 74.41 109.051 175.202 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.422 ' HB3' HD11 ' A' ' 44' ' ' LEU . . . -58.53 -45.91 87.89 Favored 'General case' 0 C--O 1.244 0.786 0 CA-C-N 114.368 -1.287 . . . . 73.2 112.292 -175.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.401 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 22.4 ptmt -69.45 -37.02 77.17 Favored 'General case' 0 C--N 1.353 0.749 0 O-C-N 123.525 0.515 . . . . 74.05 110.46 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.404 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 40.0 mt-10 -64.38 -34.03 77.23 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.319 0.647 . . . . 72.51 111.067 179.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.478 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 30.5 mmmt -69.87 -35.49 74.72 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.06 0.457 . . . . 74.32 110.504 178.088 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.735 ' HB3' HD13 ' A' ' 46' ' ' LEU . 41.7 mt -72.61 -23.57 60.96 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 115.257 -0.883 . . . . 74.31 111.299 173.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 96.4 mt -85.18 -17.66 36.47 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.986 0.914 . . . . 75.44 111.462 175.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.404 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 15.1 mm-40 -71.91 -44.13 64.2 Favored 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 108.467 -0.938 . . . . 72.25 108.467 169.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -78.52 -32.76 48.21 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 114.732 -1.122 . . . . 74.13 111.322 -177.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.554 ' HB2' HD11 ' A' ' 46' ' ' LEU . 49.0 m -154.83 80.9 4.38 Favored Pre-proline 0 CA--C 1.562 1.408 0 C-N-CA 123.854 0.861 . . . . 72.14 110.368 -173.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.2 -27.07 17.09 Favored 'Trans proline' 0 C--N 1.375 1.957 0 C-N-CA 122.722 2.282 . . . . 72.21 113.308 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -83.84 -9.67 58.59 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.343 0.657 . . . . 73.53 111.488 -177.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 38.0 m -89.34 145.98 25.0 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.274 0.63 . . . . 64.33 111.188 -177.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.29 109.18 20.1 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.6 0.76 . . . . 71.43 109.641 -178.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 64.5 t -97.61 122.0 48.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 C-N-CA 124.05 0.94 . . . . 63.42 109.249 -175.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 73.6 mm-40 -101.37 148.44 25.15 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.492 1.117 . . . . 74.35 108.686 177.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 59.0 t -78.58 106.98 10.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 N-CA-C 107.68 -1.23 . . . . 71.52 107.68 166.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.7 tpt180 -82.12 -61.68 1.84 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 122.609 0.364 . . . . 73.02 110.021 -177.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -147.47 170.05 18.22 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 125.177 1.391 . . . . 73.24 109.359 179.064 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.408 HG11 HG23 ' A' ' 42' ' ' VAL . 61.4 t -135.57 114.85 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 N-CA-C 108.134 -1.062 . . . . 70.22 108.134 173.218 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -107.88 110.81 22.67 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.534 0.734 . . . . 73.42 109.219 -179.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.47 ' HG2' HG12 ' A' ' 40' ' ' ILE . 2.5 tmtp? -92.43 108.74 20.19 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 108.602 -0.888 . . . . 74.14 108.602 -176.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -121.31 83.26 2.05 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.492 0.717 . . . . 72.53 110.026 -178.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.77 -108.96 2.66 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 115.206 -0.907 . . . . 72.23 112.889 178.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -93.34 -27.51 16.73 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.334 0.653 . . . . 70.5 110.2 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 32.6 m -93.11 97.72 10.85 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 123.6 0.76 . . . . 74.31 110.489 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.47 HG12 ' HG2' ' A' ' 35' ' ' LYS . 36.0 mt -86.19 107.45 16.58 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 N-CA-C 108.549 -0.908 . . . . 73.54 108.549 173.105 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 52.0 mtt85 -89.0 96.66 10.82 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.395 1.078 . . . . 74.34 109.797 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.408 HG23 HG11 ' A' ' 33' ' ' VAL . 57.3 t -80.82 124.45 38.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 108.575 -0.898 . . . . 74.03 108.575 175.357 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -90.94 124.09 34.94 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 107.966 -1.124 . . . . 72.15 107.966 174.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.422 HD11 ' HB3' ' A' ' 15' ' ' ALA . 2.0 mp -128.43 150.01 50.31 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 109.156 -0.683 . . . . 74.22 109.156 -179.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -108.81 106.04 15.88 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.376 0.608 . . . . 60.44 109.567 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.735 HD13 ' HB3' ' A' ' 19' ' ' LEU . 9.3 tt -92.68 109.11 20.53 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 107.527 -1.286 . . . . 75.31 107.527 -177.032 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 . . . . . 0 CA--C 1.539 0.553 0 C-N-CA 124.371 1.068 . . . . 71.34 109.59 -175.592 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.0 tttt . . . . . 0 C--O 1.237 0.419 0 N-CA-C 106.32 -1.733 . . . . 75.15 106.32 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -114.19 141.46 47.5 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.66 0.784 . . . . 70.04 109.641 -171.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -111.96 117.0 31.51 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 108.877 -0.786 . . . . 54.15 108.877 174.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -108.1 120.6 42.8 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.65 1.18 . . . . 75.03 110.095 178.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 32.9 m -88.94 101.44 14.07 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 108.775 -0.824 . . . . 73.15 108.775 168.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.516 HG12 HG12 ' A' ' 71' ' ' ILE . 43.0 t -91.88 106.62 17.91 Favored 'Isoleucine or valine' 0 C--O 1.243 0.746 0 N-CA-C 108.554 -0.906 . . . . 72.41 108.554 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -77.38 102.91 7.02 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 114.258 -1.337 . . . . 75.44 108.831 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.57 ' HB ' HG13 ' A' ' 11' ' ' VAL . 27.0 t -111.37 130.31 65.11 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 C-N-CA 123.809 0.844 . . . . 65.31 108.893 -178.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -120.2 141.15 50.17 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.252 0.621 . . . . 74.03 110.758 -173.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -74.59 116.33 15.16 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.487 0.715 . . . . 73.31 110.492 176.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 36.1 mm-40 -117.21 107.28 14.25 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.223 1.009 . . . . 73.05 108.623 171.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 63.18 -115.24 7.75 Favored Glycine 0 C--N 1.348 1.227 0 N-CA-C 111.124 -0.79 . . . . 52.3 111.124 -172.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -91.68 -32.21 15.53 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.504 0.721 . . . . 71.32 109.934 171.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 82.0 p -82.64 173.02 12.31 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.534 0.733 . . . . 75.13 112.129 -168.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -128.66 110.92 12.64 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.141 0.976 . . . . 75.12 110.365 -174.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.3 t -93.39 160.65 14.72 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.332 0.653 . . . . 61.22 110.672 177.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.466 HG21 ' HG3' ' A' ' 18' ' ' LYS . 48.1 t -100.42 120.86 50.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 123.203 0.601 . . . . 74.13 109.447 174.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -83.47 -53.07 5.97 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 123.938 0.895 . . . . 75.01 110.618 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 21.5 tpp180 -165.27 144.16 6.47 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.161 0.584 . . . . 72.05 110.422 177.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.516 HG12 HG12 ' A' ' 57' ' ' VAL . 59.2 mt -103.73 105.94 19.31 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 N-CA-C 107.934 -1.136 . . . . 74.44 107.934 172.032 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 57.4 m -97.98 103.89 15.87 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.621 0.769 . . . . 72.53 109.216 -178.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 36.3 ttp180 -85.93 147.4 26.26 Favored 'General case' 0 C--O 1.243 0.724 0 N-CA-C 109.501 -0.555 . . . . 75.32 109.501 175.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 10.0 t . . . . . 0 CA--C 1.554 1.118 0 O-C-N 123.771 0.669 . . . . 72.44 110.151 171.272 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 . . . . . 0 N--CA 1.478 0.939 0 N-CA-C 111.672 0.249 . . . . 74.43 111.672 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.452 ' O ' HG21 ' A' ' 11' ' ' VAL . 44.7 mt-10 -52.4 -52.57 53.09 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 124.322 1.014 . . . . 72.41 110.448 175.609 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.452 ' O ' ' HG3' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -62.38 -42.42 99.4 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 124.545 1.153 . . . . 70.11 109.529 -175.731 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -59.58 -42.66 93.01 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.145 0.978 . . . . 75.42 110.567 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 61.7 mt-30 -66.44 -49.79 65.53 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.218 1.007 . . . . 72.33 110.874 177.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.521 HG23 HD12 ' A' ' 40' ' ' ILE . 86.4 t -67.52 -35.27 72.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 124.012 0.925 . . . . 75.12 112.111 -170.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.452 ' HG3' ' O ' ' A' ' 8' ' ' LYS . 53.4 mtmt -60.75 -36.36 78.72 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 122.704 0.402 . . . . 72.41 110.513 176.36 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.45 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 9.8 tt0 -71.39 -49.55 40.95 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 115.421 -0.809 . . . . 75.42 110.07 176.087 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.509 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 67.7 t -55.43 -40.25 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 123.396 0.678 . . . . 62.12 110.487 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.73 -47.64 58.67 Favored 'General case' 0 C--O 1.245 0.865 0 C-N-CA 124.603 1.161 . . . . 74.34 111.745 -176.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -66.83 -33.92 76.67 Favored 'General case' 0 C--N 1.358 0.952 0 CA-C-N 116.134 -0.485 . . . . 72.4 110.714 -176.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 13' ' ' GLN . 53.0 mt-10 -61.18 -41.33 96.61 Favored 'General case' 0 C--N 1.36 1.047 0 O-C-N 124.064 0.852 . . . . 73.13 110.599 179.201 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.587 ' HG3' HG22 ' A' ' 68' ' ' VAL . 71.8 mmtt -68.25 -35.2 77.54 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 123.802 0.689 . . . . 72.31 110.825 -178.337 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 77.6 mt -70.08 -30.04 67.18 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.107 0.563 . . . . 74.11 111.535 173.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 95.1 mt -81.38 -16.77 51.24 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.667 0.787 . . . . 75.31 110.737 175.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -81.2 -46.1 15.36 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 109.427 -0.582 . . . . 73.3 109.427 172.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -71.85 -24.34 61.67 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.291 0.636 . . . . 73.54 111.319 178.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 t -158.01 82.83 2.83 Favored Pre-proline 0 CA--C 1.558 1.273 0 O-C-N 123.421 0.45 . . . . 64.24 110.138 -178.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -61.37 -33.57 88.63 Favored 'Trans proline' 0 C--N 1.381 2.282 0 C-N-CA 123.411 2.741 . . . . 75.32 115.01 -177.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -76.14 -18.45 59.12 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 122.815 0.446 . . . . 65.24 112.103 -175.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 58.3 m -76.64 148.68 36.75 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.381 0.672 . . . . 74.11 111.797 -177.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.51 ' HE3' ' HA ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -103.34 116.33 32.24 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.913 0.885 . . . . 72.34 109.77 174.107 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 51.1 t -99.36 141.24 17.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 CA-C-N 114.705 -1.134 . . . . 75.11 109.525 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -131.63 110.78 11.17 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 108.005 -1.109 . . . . 75.12 108.005 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.436 HG23 ' HB3' ' A' ' 12' ' ' LYS . 73.9 t -58.73 114.57 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 N-CA-C 109.434 -0.58 . . . . 73.14 109.434 178.106 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -92.29 -46.64 7.61 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 123.882 0.739 . . . . 74.1 110.756 -171.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 21.0 tpt180 -157.24 155.33 30.63 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.455 0.702 . . . . 72.23 109.951 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 89.9 t -126.42 141.46 45.83 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 124.33 1.052 . . . . 73.01 109.43 176.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 74.2 mm-40 -128.01 109.17 11.3 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 124.353 1.061 . . . . 65.04 108.931 177.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -92.12 110.72 22.1 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 108.084 -1.08 . . . . 71.52 108.084 178.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -122.9 90.28 3.26 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.314 0.646 . . . . 73.1 110.104 -179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.56 -81.95 0.95 Allowed Glycine 0 C--N 1.35 1.352 0 CA-C-N 116.246 -0.433 . . . . 70.42 112.485 177.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -142.86 1.07 1.27 Allowed 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.695 1.198 . . . . 74.5 110.61 169.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 23.5 m -98.13 97.76 9.15 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.755 -0.831 . . . . 72.1 108.755 174.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.521 HD12 HG23 ' A' ' 11' ' ' VAL . 32.5 mt -92.49 107.66 19.27 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 C-N-CA 123.371 0.669 . . . . 74.3 110.067 178.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.515 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 94.3 mtt180 -87.41 105.26 17.15 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.389 1.076 . . . . 73.35 109.304 174.592 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 50.1 t -96.98 119.51 45.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 N-CA-C 109.086 -0.709 . . . . 74.33 109.086 175.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.476 ' HB3' HD22 ' A' ' 54' ' ' ASN . 7.1 mp0 -83.16 116.58 22.42 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 108.62 -0.882 . . . . 72.44 108.62 170.126 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.4 mp -116.23 153.64 31.51 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 109.088 -0.708 . . . . 75.34 109.088 176.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -115.76 104.23 11.46 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 124.191 0.996 . . . . 74.02 108.474 -171.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.0 tt -98.95 111.15 23.63 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 108.36 -0.978 . . . . 75.22 108.36 -173.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 57.4 mtt85 . . . . . 0 N--CA 1.474 0.757 0 C-N-CA 123.664 0.786 . . . . 74.31 110.152 -176.254 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.3 pttt . . . . . 0 N--CA 1.471 0.597 0 N-CA-C 109.669 -0.493 . . . . 75.44 109.669 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 49.8 mm-40 -127.38 119.62 26.61 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 107.89 -1.152 . . . . 62.55 107.89 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.476 HD22 ' HB3' ' A' ' 43' ' ' GLU . 8.2 t-20 -83.13 119.19 24.2 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 108.651 -0.87 . . . . 73.24 108.651 175.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -107.88 117.69 34.77 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 124.017 0.927 . . . . 72.01 109.303 177.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 59.0 m -84.43 100.43 11.32 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 107.909 -1.145 . . . . 72.25 107.909 168.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.428 HG21 HG21 ' A' ' 71' ' ' ILE . 57.6 t -91.99 103.83 14.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.447 0 N-CA-C 108.082 -1.081 . . . . 75.23 108.082 -179.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.515 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 30.1 mt-10 -79.01 102.13 8.18 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 114.57 -1.195 . . . . 75.44 108.723 -178.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.66 HG22 HG21 ' A' ' 68' ' ' VAL . 58.7 t -104.39 143.41 16.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 124.275 1.03 . . . . 74.42 108.894 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -136.14 147.83 47.92 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.462 0.705 . . . . 74.3 110.208 -179.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.5 tpp180 -76.57 117.58 18.36 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.785 0.834 . . . . 73.35 110.171 177.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -119.0 126.56 52.02 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 107.592 -1.262 . . . . 71.41 107.592 168.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 65.54 -104.5 1.0 Allowed Glycine 0 C--N 1.346 1.118 0 N-CA-C 111.122 -0.791 . . . . 72.12 111.122 -172.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -127.16 -5.06 6.14 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.89 0.876 . . . . 73.43 110.075 174.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 77.6 p -102.38 174.7 5.79 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.503 0.721 . . . . 73.31 111.171 -176.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -112.39 133.75 54.3 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.557 1.143 . . . . 74.41 110.637 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.1 t -128.23 151.99 48.62 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.26 1.024 . . . . 74.42 108.932 177.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.66 HG21 HG22 ' A' ' 59' ' ' VAL . 77.9 t -92.52 119.25 39.78 Favored 'Isoleucine or valine' 0 C--O 1.241 0.61 0 N-CA-C 109.941 -0.392 . . . . 74.23 109.941 175.312 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -70.07 -56.79 6.0 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 114.813 -1.085 . . . . 74.54 110.607 173.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -160.62 139.23 10.16 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 123.625 0.578 . . . . 64.4 110.02 178.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.428 HG21 HG21 ' A' ' 57' ' ' VAL . 59.3 mt -89.9 105.43 16.13 Favored 'Isoleucine or valine' 0 C--O 1.239 0.517 0 N-CA-C 107.975 -1.12 . . . . 73.54 107.975 168.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 96.1 m -97.14 105.85 18.08 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.485 0.714 . . . . 75.33 109.762 175.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 12.8 ttp180 -71.22 149.28 46.43 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 109.192 -0.67 . . . . 75.3 109.192 172.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 12.0 t . . . . . 0 CA--C 1.543 0.696 0 N-CA-C 109.423 -0.584 . . . . 74.52 109.423 175.028 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 . . . . . 0 N--CA 1.481 1.087 0 CA-C-O 121.281 0.562 . . . . 72.22 110.626 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.521 ' O ' HG21 ' A' ' 11' ' ' VAL . 20.2 mm-40 -64.36 -39.73 94.45 Favored 'General case' 0 C--O 1.207 -1.162 0 CA-C-O 118.008 -0.996 . . . . 75.03 111.06 178.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.3 mptt -59.55 -36.4 76.11 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-N 119.319 0.963 . . . . 75.23 110.956 176.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -59.51 -31.33 69.27 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.281 0.632 . . . . 75.1 110.694 176.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.42 ' O ' HG21 ' A' ' 14' ' ' VAL . 38.3 mt-30 -82.45 -47.61 12.04 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 115.444 -0.798 . . . . 65.22 111.887 174.326 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.551 HG23 HD12 ' A' ' 40' ' ' ILE . 73.1 t -73.1 -45.5 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.186 0 C-N-CA 123.783 0.833 . . . . 72.21 112.08 -165.312 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.61 ' HD2' HG13 ' A' ' 30' ' ' VAL . 25.8 mtmm -69.43 -26.16 64.47 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 109.565 -0.532 . . . . 64.42 109.565 179.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.424 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 23.0 tt0 -71.34 -44.84 64.31 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.2 1.0 . . . . 63.41 110.318 176.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.458 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 82.6 t -61.51 -48.14 90.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 N-CA-C 108.85 -0.796 . . . . 72.53 108.85 174.341 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.9 -39.84 93.36 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.49 1.116 . . . . 75.24 112.228 -174.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -69.94 -38.05 76.07 Favored 'General case' 0 C--N 1.355 0.826 0 O-C-N 123.263 0.352 . . . . 74.24 110.278 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 28.2 mm-40 -68.23 -34.8 76.89 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 122.743 0.417 . . . . 74.5 110.618 177.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.537 ' HB3' HD11 ' A' ' 71' ' ' ILE . 31.7 mmmt -63.84 -33.0 74.71 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 122.952 0.501 . . . . 70.33 110.813 176.139 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.762 ' HB3' HD13 ' A' ' 46' ' ' LEU . 32.6 mt -76.15 -36.97 58.53 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.733 -0.667 . . . . 73.31 111.532 174.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.0 mt -73.58 -16.38 61.25 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.251 0.62 . . . . 74.43 111.614 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -61.77 -39.5 91.86 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.433 0.635 . . . . 73.23 110.508 167.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.47 HE22 HG22 ' A' ' 71' ' ' ILE . 42.9 mt-30 -84.8 -34.25 22.79 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 114.445 -1.252 . . . . 64.14 110.976 -175.524 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.406 ' HB3' HD11 ' A' ' 46' ' ' LEU . 15.2 t -153.03 88.81 3.77 Favored Pre-proline 0 CA--C 1.555 1.159 0 N-CA-C 109.169 -0.678 . . . . 74.34 109.169 -177.411 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -62.54 -44.57 17.33 Favored 'Trans proline' 0 C--N 1.384 2.418 0 C-N-CA 123.425 2.75 . . . . 72.3 114.36 -176.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -83.15 -2.99 56.88 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.359 0.663 . . . . 74.23 112.006 -171.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.6 t -83.74 158.39 21.79 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 122.922 0.489 . . . . 71.31 111.218 177.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.538 ' HZ2' ' HB2' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -92.34 134.13 35.2 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 123.481 0.712 . . . . 72.42 109.86 177.677 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.439 ' HA ' ' O ' ' A' ' 45' ' ' GLU . 80.9 t -117.21 113.98 44.35 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 C-N-CA 123.522 0.729 . . . . 73.12 109.912 177.215 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -109.48 122.12 46.7 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.459 1.104 . . . . 61.04 109.062 172.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.61 HG13 ' HD2' ' A' ' 12' ' ' LYS . 57.5 t -65.79 116.33 4.92 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 N-CA-C 109.238 -0.653 . . . . 75.32 109.238 176.042 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.0 tpt180 -83.14 -51.89 7.11 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.389 0.676 . . . . 64.4 110.267 -174.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 37.1 mtp85 -146.0 156.4 43.47 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.6 1.16 . . . . 72.24 109.67 -177.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 75.1 t -132.64 117.62 31.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 C-N-CA 123.891 0.876 . . . . 70.12 108.839 175.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -112.91 128.44 56.47 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.21 0.604 . . . . 74.31 110.033 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.5 tptp -108.66 109.76 21.03 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.296 1.039 . . . . 74.21 108.792 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.0 mm-40 -132.1 103.17 6.12 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.426 0.69 . . . . 72.33 109.953 -178.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.34 -101.99 0.89 Allowed Glycine 0 C--N 1.356 1.676 0 CA-C-N 115.92 -0.582 . . . . 74.12 112.519 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -113.22 -23.22 10.07 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.524 0.73 . . . . 75.12 109.715 173.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 16.6 m -85.14 105.71 16.06 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.491 0.716 . . . . 65.21 110.437 -176.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.551 HD12 HG23 ' A' ' 11' ' ' VAL . 31.2 mt -85.46 108.1 16.86 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 N-CA-C 109.29 -0.633 . . . . 73.15 109.29 168.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 -87.71 95.93 10.25 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 108.458 -0.942 . . . . 75.21 108.458 175.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.5 t -88.15 118.38 33.66 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 N-CA-C 108.824 -0.806 . . . . 75.53 108.824 179.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -90.3 120.85 31.79 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 108.605 -0.887 . . . . 73.21 108.605 173.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.5 mp -122.44 170.05 10.36 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 109.728 -0.471 . . . . 74.35 109.728 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.567 ' HG3' ' HG3' ' A' ' 52' ' ' LYS . 29.4 tt0 -120.7 105.16 10.51 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.48 1.112 . . . . 73.11 108.695 -176.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.762 HD13 ' HB3' ' A' ' 19' ' ' LEU . 6.9 tt -107.27 133.83 51.25 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 106.402 -1.703 . . . . 73.53 106.402 172.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 87.1 mtt180 . . . . . 0 CA--C 1.539 0.534 0 CA-C-O 121.834 0.826 . . . . 74.51 109.66 -174.096 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.583 ' HE2' HD22 ' A' ' 54' ' ' ASN . 84.4 tttt . . . . . 0 CA--C 1.541 0.623 0 N-CA-C 109.766 -0.457 . . . . 74.14 109.766 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -111.89 118.87 36.71 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 107.851 -1.166 . . . . 71.4 107.851 172.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.583 HD22 ' HE2' ' A' ' 52' ' ' LYS . 43.6 m-80 -88.06 132.9 34.11 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 109.878 -0.415 . . . . 73.21 109.878 177.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.435 ' CE2' ' HB3' ' A' ' 46' ' ' LEU . 66.6 m-85 -124.07 119.8 30.55 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 109.167 -0.679 . . . . 63.43 109.167 178.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 26.7 m -87.11 101.9 13.93 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 108.507 -0.923 . . . . 51.5 108.507 173.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.449 HG21 HG23 ' A' ' 71' ' ' ILE . 46.3 t -92.04 104.6 15.75 Favored 'Isoleucine or valine' 0 C--O 1.24 0.595 0 N-CA-C 108.007 -1.109 . . . . 74.11 108.007 177.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -80.93 105.24 12.01 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 114.511 -1.222 . . . . 75.55 109.344 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 20.8 t -112.91 134.57 55.11 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 108.806 -0.812 . . . . 75.54 108.806 178.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -121.95 142.71 50.02 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.302 0.641 . . . . 64.35 111.183 -174.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.85 114.92 19.14 Favored 'General case' 0 C--N 1.35 0.596 0 C-N-CA 123.787 0.835 . . . . 74.13 109.53 174.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -120.84 102.92 8.69 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 107.647 -1.242 . . . . 65.41 107.647 172.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 72.66 -99.53 0.92 Allowed Glycine 0 C--N 1.347 1.177 0 N-CA-C 110.211 -1.156 . . . . 74.43 110.211 -172.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -122.48 -19.19 6.45 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.303 1.041 . . . . 72.02 110.261 169.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 68.1 p -76.79 136.97 38.99 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 122.911 0.485 . . . . 75.22 111.364 -175.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -96.23 111.81 23.75 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.07 0.948 . . . . 75.23 109.891 177.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.2 t -105.01 139.73 39.25 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.734 0.814 . . . . 75.14 109.844 -177.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.463 HG23 ' HG3' ' A' ' 18' ' ' LYS . 59.0 t -91.14 116.65 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 O-C-N 121.709 -0.619 . . . . 72.33 110.379 177.198 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -71.37 -57.38 4.51 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.532 1.133 . . . . 55.45 111.091 175.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -162.09 133.53 5.29 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.584 -0.734 . . . . 52.23 109.844 -173.031 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.537 HD11 ' HB3' ' A' ' 18' ' ' LYS . 56.5 mt -91.48 105.21 16.3 Favored 'Isoleucine or valine' 0 C--O 1.241 0.614 0 N-CA-C 106.636 -1.616 . . . . 73.33 106.636 163.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 27.2 m -101.25 108.46 20.12 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.108 -0.701 . . . . 75.51 109.108 -176.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -67.54 138.67 56.68 Favored 'General case' 0 C--O 1.241 0.625 0 N-CA-C 108.81 -0.811 . . . . 74.43 108.81 171.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.1 t . . . . . 0 C--O 1.247 0.934 0 C-N-CA 123.58 0.752 . . . . 73.25 110.605 175.285 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.445 ' HA ' ' HD2' ' A' ' 9' ' ' ARG . 11.7 tp10 . . . . . 0 C--O 1.245 0.816 0 N-CA-C 111.312 0.116 . . . . 74.23 111.312 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.519 ' O ' HG22 ' A' ' 11' ' ' VAL . 72.9 mt-10 -50.5 -66.74 0.34 Allowed 'General case' 0 C--N 1.364 1.205 0 O-C-N 124.022 0.826 . . . . 70.35 109.981 173.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.461 ' HD2' ' HB2' ' A' ' 7' ' ' GLU . 10.6 mptt -66.0 -27.82 68.42 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 123.908 0.755 . . . . 74.43 111.295 -169.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.445 ' HD2' ' HA ' ' A' ' 6' ' ' GLU . 90.5 mtt180 -59.71 -40.14 86.94 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.091 0.556 . . . . 75.34 110.398 176.295 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -77.91 -51.38 10.51 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 115.107 -0.951 . . . . 74.53 110.751 173.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.519 HG22 ' O ' ' A' ' 7' ' ' GLU . 52.0 t -66.04 -44.77 91.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 123.653 0.781 . . . . 64.5 112.486 -164.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 29.1 mtmm -66.05 -31.97 73.16 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 123.165 0.29 . . . . 75.13 110.394 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.406 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 8.4 tt0 -70.76 -43.82 68.01 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 124.107 0.879 . . . . 74.3 110.185 178.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.474 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 87.8 t -65.08 -39.83 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 N-CA-C 109.557 -0.534 . . . . 65.22 109.557 176.023 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.91 -44.2 81.37 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.198 0.999 . . . . 71.51 111.598 -175.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -67.85 -34.82 77.45 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 123.793 0.683 . . . . 75.44 110.164 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.47 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 22.4 mm-40 -61.01 -46.02 92.46 Favored 'General case' 0 C--N 1.356 0.848 0 O-C-N 123.633 0.583 . . . . 71.45 111.077 177.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.533 ' HG3' HG22 ' A' ' 68' ' ' VAL . 71.5 mmtt -67.22 -30.66 70.65 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.669 0.606 . . . . 75.45 111.09 -178.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.555 ' HB3' HD12 ' A' ' 46' ' ' LEU . 41.7 mt -70.15 -36.26 74.62 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.396 0.678 . . . . 64.24 111.442 174.29 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.3 mt -76.06 -22.89 55.15 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 123.764 0.826 . . . . 72.13 110.57 176.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 7.4 mm-40 -69.15 -36.94 77.97 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.261 0.624 . . . . 75.14 110.147 171.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -76.16 -42.06 47.86 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.21 0.604 . . . . 73.12 110.944 176.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.4 t -148.85 96.71 3.75 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 123.062 0.545 . . . . 73.22 110.368 -174.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -82.55 -1.98 10.83 Favored 'Trans proline' 0 C--N 1.372 1.805 0 C-N-CA 123.228 2.619 . . . . 71.4 112.434 172.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -83.41 -3.88 57.97 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.671 1.188 . . . . 72.33 111.676 178.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 34.4 p -127.09 142.56 51.49 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.382 0.673 . . . . 74.42 111.979 -168.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -77.85 136.43 38.07 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 123.818 0.699 . . . . 74.34 109.587 169.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 60.3 t -112.61 134.99 53.43 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 C-N-CA 123.973 0.909 . . . . 74.03 108.938 177.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -128.95 149.6 50.73 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.826 0.851 . . . . 70.11 109.396 176.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 73.8 t -77.05 110.35 12.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 N-CA-C 109.96 -0.385 . . . . 73.54 109.96 176.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -81.44 -59.57 2.58 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.656 0.782 . . . . 64.14 110.09 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.412 ' HB2' ' HB2' ' A' ' 43' ' ' GLU . 17.6 mmm180 -148.82 167.26 26.12 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.885 1.274 . . . . 71.23 108.981 -176.276 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 59.2 t -135.45 139.76 46.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 N-CA-C 108.704 -0.85 . . . . 72.21 108.704 171.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.404 ' O ' ' HA ' ' A' ' 40' ' ' ILE . 8.6 tp-100 -125.6 108.25 11.39 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 109.112 -0.699 . . . . 75.04 109.112 178.579 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -96.43 113.51 25.1 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 107.972 -1.122 . . . . 74.04 107.972 176.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 92.4 mm-40 -131.96 99.05 4.61 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.879 -0.786 . . . . 74.51 108.879 176.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 63.06 -102.53 0.53 Allowed Glycine 0 C--N 1.348 1.238 0 O-C-N 124.386 1.054 . . . . 72.3 112.908 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.462 HD21 ' HB3' ' A' ' 61' ' ' ARG . 18.1 m120 -97.15 -39.76 9.13 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.571 0.748 . . . . 75.14 109.838 174.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.452 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 11.5 m -80.69 96.42 6.9 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 123.296 0.638 . . . . 73.35 110.803 -172.061 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.404 ' HA ' ' O ' ' A' ' 34' ' ' GLN . 28.8 mt -87.54 107.32 17.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 115.779 -0.646 . . . . 72.44 109.357 168.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 31.6 mtm180 -87.82 96.07 10.33 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 108.01 -1.107 . . . . 73.52 108.01 174.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 48.6 t -82.59 121.17 35.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 N-CA-C 109.034 -0.728 . . . . 74.41 109.034 177.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.412 ' HB2' ' HB2' ' A' ' 32' ' ' ARG . 37.6 mt-10 -89.45 118.11 28.86 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.416 -0.811 . . . . 75.54 109.095 176.116 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.8 mp -122.99 164.04 19.29 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 108.823 -0.806 . . . . 74.12 108.823 176.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -125.56 111.82 15.48 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.633 0.773 . . . . 71.02 108.916 -169.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.555 HD12 ' HB3' ' A' ' 19' ' ' LEU . 8.5 tt -120.41 137.68 54.18 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.173 1.389 . . . . 70.23 108.361 -171.733 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 14.5 mtm180 . . . . . 0 N--CA 1.48 1.07 0 N-CA-C 109.476 -0.565 . . . . 74.22 109.476 -178.507 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt . . . . . 0 C--O 1.241 0.629 0 N-CA-C 108.983 -0.747 . . . . 73.22 108.983 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -108.59 134.61 51.11 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.907 0.883 . . . . 72.13 110.399 -175.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -88.43 120.87 30.21 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.633 -0.712 . . . . 74.54 110.525 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.507 ' CE2' ' HB3' ' A' ' 46' ' ' LEU . 19.1 m-85 -104.71 157.8 16.94 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.02 0.928 . . . . 65.31 109.801 177.496 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 85.3 m -134.23 103.04 5.59 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 107.984 -1.117 . . . . 74.11 107.984 173.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.403 HG22 HG21 ' A' ' 71' ' ' ILE . 52.0 t -90.1 105.25 16.01 Favored 'Isoleucine or valine' 0 C--O 1.241 0.647 0 N-CA-C 107.56 -1.274 . . . . 75.33 107.56 -179.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -77.12 111.27 12.54 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 114.891 -1.049 . . . . 62.31 109.129 -179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 24.7 t -122.81 122.59 66.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 123.635 0.774 . . . . 51.01 109.39 -178.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.452 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 29.8 tt0 -105.85 145.57 31.05 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.114 0.965 . . . . 72.3 110.859 -176.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.462 ' HB3' HD21 ' A' ' 38' ' ' ASN . 14.5 tpp180 -75.42 121.25 22.02 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 109.782 -0.451 . . . . 75.1 109.782 171.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -117.39 101.8 8.7 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.503 -0.925 . . . . 73.42 108.503 167.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.75 -106.24 1.76 Allowed Glycine 0 C--N 1.348 1.239 0 CA-C-N 115.96 -0.564 . . . . 64.32 111.98 -178.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -108.98 -19.71 13.3 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.342 0.657 . . . . 64.32 110.296 177.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.2 p -93.76 173.88 7.46 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.465 0.65 . . . . 73.3 111.442 -178.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -116.08 150.55 37.15 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.479 1.111 . . . . 75.22 109.442 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.3 t -134.77 123.15 23.14 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 109.457 -0.571 . . . . 72.34 109.457 -179.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.533 HG22 ' HG3' ' A' ' 18' ' ' LYS . 95.5 t -74.93 103.67 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 N-CA-C 108.812 -0.81 . . . . 75.31 108.812 175.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.523 ' HZ3' ' HB3' ' A' ' 69' ' ' LYS . 3.5 mmmp? -64.4 -52.77 56.54 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 123.934 0.894 . . . . 74.03 110.196 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -163.62 152.61 14.17 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.464 -0.789 . . . . 70.23 109.895 178.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.523 HD13 ' HB3' ' A' ' 18' ' ' LYS . 70.5 mt -101.95 110.14 27.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 N-CA-C 108.029 -1.1 . . . . 74.51 108.029 170.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 17.4 m -91.65 142.8 27.23 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 108.542 -0.91 . . . . 75.02 108.542 178.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 27.9 ttp180 -118.31 144.33 45.93 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 107.536 -1.283 . . . . 73.23 107.536 168.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.4 t . . . . . 0 C--O 1.248 0.996 0 C-N-CA 122.943 0.497 . . . . 75.53 109.994 176.294 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.414 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 45.2 mt-10 . . . . . 0 N--CA 1.481 1.085 0 N-CA-C 110.348 -0.241 . . . . 74.35 110.348 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.473 ' O ' HG23 ' A' ' 11' ' ' VAL . 51.1 mm-40 -63.47 -40.93 98.42 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 123.899 0.749 . . . . 75.13 111.35 178.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.19 -41.65 98.55 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.247 0.619 . . . . 61.55 110.32 179.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -58.83 -44.79 90.97 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 124.026 0.93 . . . . 75.12 110.822 175.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.436 ' O ' HG22 ' A' ' 14' ' ' VAL . 68.5 mt-30 -62.96 -45.11 93.97 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 114.904 -1.044 . . . . 74.44 111.089 179.249 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.528 HG22 HD12 ' A' ' 40' ' ' ILE . 87.6 t -66.71 -43.51 90.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 123.621 0.769 . . . . 74.52 111.423 -176.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -61.45 -37.69 84.49 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 123.486 0.491 . . . . 75.54 110.442 176.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.507 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.5 tt0 -65.79 -49.14 69.38 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 124.119 0.887 . . . . 74.43 110.323 179.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.436 HG22 ' O ' ' A' ' 10' ' ' GLN . 89.0 t -58.12 -45.69 88.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 C-N-CA 123.068 0.547 . . . . 64.12 109.784 176.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.84 -42.29 97.63 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.175 0.99 . . . . 74.52 112.179 -175.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -73.72 -35.44 65.09 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 116.317 -0.401 . . . . 75.34 110.667 -176.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.507 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 25.3 mm-40 -65.87 -37.13 85.33 Favored 'General case' 0 C--N 1.353 0.732 0 O-C-N 123.422 0.451 . . . . 75.33 110.369 176.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.537 ' HB3' HD13 ' A' ' 71' ' ' ILE . 65.9 mmtt -63.26 -37.1 85.94 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.347 0.659 . . . . 74.53 110.897 176.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 23.8 mt -72.49 -30.65 64.71 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 115.85 -0.614 . . . . 71.12 111.414 176.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 75.5 mt -76.19 -19.68 58.2 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.333 0.653 . . . . 75.54 111.045 177.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -77.0 -21.12 55.17 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.018 0.527 . . . . 71.22 110.714 170.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 -88.64 -38.12 15.06 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.165 0.586 . . . . 73.25 110.226 175.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.8 t -157.31 102.51 1.87 Allowed Pre-proline 0 CA--C 1.552 1.048 0 C-N-CA 124.208 1.003 . . . . 42.32 109.215 -176.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -77.04 -27.61 6.69 Favored 'Trans proline' 0 C--N 1.373 1.824 0 C-N-CA 122.796 2.331 . . . . 74.24 112.851 -176.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -74.46 -27.93 60.8 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.766 0.826 . . . . 74.33 111.18 -173.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 54.5 m -80.47 130.04 34.9 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 123.299 0.64 . . . . 74.13 111.373 -174.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -73.67 123.49 24.15 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 123.509 0.724 . . . . 75.14 109.697 175.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.529 HG23 HD13 ' A' ' 46' ' ' LEU . 40.8 t -99.68 113.29 34.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 123.315 0.646 . . . . 74.34 109.617 -177.074 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -94.61 151.72 19.09 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.945 -0.761 . . . . 75.14 108.945 174.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 p -87.09 105.75 15.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 N-CA-C 108.936 -0.765 . . . . 72.03 108.936 171.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -77.21 -42.7 36.41 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.249 0.62 . . . . 72.41 110.435 -177.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 17.5 tpp85 -170.01 155.55 5.63 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.976 0.91 . . . . 74.43 109.452 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 25.2 t -117.21 117.19 54.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.354 -0.98 . . . . 73.43 108.354 171.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -104.55 145.59 30.09 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 109.423 -0.584 . . . . 70.14 109.423 174.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.548 ' HG2' HG12 ' A' ' 40' ' ' ILE . 13.2 tmtt? -136.53 117.25 13.99 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 107.166 -1.42 . . . . 74.13 107.166 -177.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -133.25 96.3 3.71 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.082 0.953 . . . . 72.45 108.733 -175.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.47 -92.76 0.28 Allowed Glycine 0 C--N 1.348 1.248 0 O-C-N 123.555 0.535 . . . . 72.53 112.215 -177.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.428 ' HB3' ' HB3' ' A' ' 61' ' ' ARG . 19.3 m120 -114.18 -25.23 8.57 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.971 0.909 . . . . 75.23 110.741 175.079 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.561 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 19.9 m -81.79 103.8 11.73 Favored 'General case' 0 C--O 1.24 0.587 0 C-N-CA 123.158 0.583 . . . . 75.11 111.252 -176.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.548 HG12 ' HG2' ' A' ' 35' ' ' LYS . 39.6 mt -86.76 107.12 16.54 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 N-CA-C 109.063 -0.717 . . . . 72.51 109.063 168.4 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.433 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 95.0 mtt180 -92.29 96.72 10.45 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 108.406 -0.961 . . . . 74.23 108.406 176.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.401 HG13 ' HG ' ' A' ' 44' ' ' LEU . 39.2 t -80.25 120.7 32.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 N-CA-C 108.421 -0.955 . . . . 73.23 108.421 176.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -84.89 115.49 22.8 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 107.482 -1.303 . . . . 74.53 107.482 170.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.401 ' HG ' HG13 ' A' ' 42' ' ' VAL . 1.9 mp -117.82 142.87 46.82 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 109.594 -0.521 . . . . 75.33 109.594 178.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -107.2 104.82 14.55 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.916 0.886 . . . . 72.02 108.787 -175.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.529 HD13 HG23 ' A' ' 28' ' ' VAL . 8.3 tt -117.2 135.46 53.77 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.323 1.049 . . . . 74.35 108.747 -175.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 64.6 mtm180 . . . . . 0 CA--C 1.542 0.671 0 N-CA-C 109.306 -0.627 . . . . 73.33 109.306 -178.395 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.9 tttt . . . . . 0 N--CA 1.472 0.646 0 CA-C-O 120.86 0.362 . . . . 75.55 110.208 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -127.64 118.78 24.51 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.775 0.83 . . . . 72.2 109.815 -177.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -80.32 147.07 31.27 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.812 -0.81 . . . . 62.1 108.812 171.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 -129.88 120.57 25.13 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.762 0.825 . . . . 74.15 108.829 179.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 90.8 m -85.44 100.64 12.01 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 108.404 -0.962 . . . . 71.21 108.404 170.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.463 HG22 HG23 ' A' ' 71' ' ' ILE . 43.4 t -97.52 102.87 13.99 Favored 'Isoleucine or valine' 0 C--O 1.243 0.728 0 N-CA-C 107.591 -1.263 . . . . 72.25 107.591 175.075 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.433 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 31.7 mt-10 -80.57 101.52 9.21 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 114.319 -1.31 . . . . 73.24 108.483 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.508 ' HB ' HG12 ' A' ' 11' ' ' VAL . 21.2 t -109.39 109.45 28.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 N-CA-C 107.84 -1.17 . . . . 73.43 107.84 177.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.561 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 45.8 tt0 -101.9 146.34 27.97 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.729 0.811 . . . . 75.41 109.767 -175.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.428 ' HB3' ' HB3' ' A' ' 38' ' ' ASN . 8.6 tpt180 -80.49 111.24 16.72 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.659 0.784 . . . . 75.03 110.595 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 -106.11 93.5 4.65 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 108.398 -0.964 . . . . 62.52 108.398 174.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.08 -100.69 0.73 Allowed Glycine 0 C--N 1.344 1.011 0 CA-C-N 115.549 -0.75 . . . . 44.45 112.045 -177.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -105.65 -26.08 11.99 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.23 1.012 . . . . 73.41 110.831 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.2 p -93.61 160.65 14.68 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.579 0.752 . . . . 73.13 111.686 -174.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -108.16 109.81 21.3 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.625 1.17 . . . . 74.41 109.821 176.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 9.8 t -103.83 127.67 51.31 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.67 0.788 . . . . 72.42 110.712 -178.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.478 HG23 HG22 ' A' ' 59' ' ' VAL . 63.6 t -77.51 110.14 12.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 N-CA-C 109.617 -0.512 . . . . 73.32 109.617 176.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -69.05 -49.52 56.81 Favored 'General case' 0 C--O 1.24 0.58 0 C-N-CA 123.363 0.665 . . . . 74.11 110.534 178.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -166.69 143.1 4.66 Favored 'General case' 0 C--N 1.348 0.501 0 CA-C-N 116.291 -0.413 . . . . 73.2 111.49 177.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.537 HD13 ' HB3' ' A' ' 18' ' ' LYS . 56.8 mt -97.84 106.95 19.37 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 N-CA-C 107.739 -1.208 . . . . 73.13 107.739 166.442 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 37.4 m -102.51 119.73 39.31 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.307 0.643 . . . . 75.41 109.48 178.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 28.4 ttp180 -75.93 148.08 38.47 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 109.331 -0.618 . . . . 74.43 109.331 176.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.4 t . . . . . 0 N--CA 1.478 0.925 0 C-N-CA 124.394 1.078 . . . . 73.23 112.616 -173.106 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 . . . . . 0 N--CA 1.472 0.647 0 N-CA-C 111.769 0.285 . . . . 65.14 111.769 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.468 ' O ' HG22 ' A' ' 11' ' ' VAL . 9.8 mm-40 -57.42 -43.32 83.7 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.987 0.915 . . . . 72.43 111.914 -175.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.442 ' HD2' ' N ' ' A' ' 8' ' ' LYS . 10.5 mptt -68.76 -48.21 64.3 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 108.872 -0.788 . . . . 74.12 108.872 -179.276 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -59.13 -34.53 72.16 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.697 1.199 . . . . 75.45 112.117 -177.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -70.89 -53.62 14.45 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.633 0.773 . . . . 72.22 110.817 178.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.624 HG12 ' HB ' ' A' ' 59' ' ' VAL . 59.8 t -63.36 -44.59 99.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 123.27 0.628 . . . . 75.31 111.639 -172.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.571 ' HD2' HG13 ' A' ' 30' ' ' VAL . 48.2 mtmt -66.02 -33.8 76.63 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.396 0.679 . . . . 74.31 110.592 -179.376 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.503 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.4 tt0 -66.45 -59.11 3.97 Favored 'General case' 0 C--N 1.355 0.811 0 O-C-N 123.96 0.788 . . . . 70.01 109.699 176.215 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.4 t -52.49 -44.77 45.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 C-N-CA 124.435 1.094 . . . . 71.23 111.129 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.69 -42.05 98.41 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.282 1.033 . . . . 64.23 111.646 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.3 tttm -65.54 -43.72 89.09 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.441 1.096 . . . . 74.24 110.719 175.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 15.7 mm-40 -61.24 -41.91 97.71 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 123.843 0.715 . . . . 74.15 110.573 -177.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -64.56 -41.52 96.26 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 124.196 0.935 . . . . 75.11 110.966 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.441 HD23 ' NE2' ' A' ' 22' ' ' GLN . 77.3 mt -70.17 -27.61 64.66 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.0 0.52 . . . . 75.01 111.733 177.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 90.6 mt -73.63 -33.89 64.75 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.436 0.694 . . . . 74.14 110.36 174.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -71.1 -36.68 72.26 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.475 0.71 . . . . 74.13 110.783 177.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.441 ' NE2' HD23 ' A' ' 19' ' ' LEU . 24.2 mt-30 -76.43 -35.55 58.45 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.558 0.743 . . . . 74.42 111.457 178.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 29.8 t -148.24 93.74 4.35 Favored Pre-proline 0 CA--C 1.55 0.971 0 N-CA-C 109.433 -0.58 . . . . 70.23 109.433 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -76.0 -4.07 14.67 Favored 'Trans proline' 0 C--N 1.378 2.119 0 C-N-CA 122.792 2.328 . . . . 71.42 112.867 173.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.438 ' N ' HD21 ' A' ' 25' ' ' ASN . 0.7 OUTLIER -83.07 -19.46 36.8 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.055 0.942 . . . . 73.54 110.059 173.627 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 39.4 t -86.45 141.02 29.43 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 123.386 0.675 . . . . 75.52 112.325 -173.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -89.87 108.93 20.0 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 107.3 -1.37 . . . . 74.13 107.3 164.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 88.6 t -98.48 113.37 32.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 C-N-CA 123.82 0.848 . . . . 74.34 109.206 -176.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 61.3 tp60 -117.87 124.21 47.75 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.578 0.751 . . . . 75.43 109.811 -178.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.571 HG13 ' HD2' ' A' ' 12' ' ' LYS . 55.8 t -62.8 108.1 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 N-CA-C 109.309 -0.626 . . . . 75.43 109.309 174.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 24.1 tpt85 -88.43 -36.27 16.6 Favored 'General case' 0 CA--C 1.549 0.915 0 CA-C-N 115.28 -0.873 . . . . 72.24 111.607 -175.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -170.0 165.49 9.44 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.328 0.651 . . . . 71.41 109.336 -177.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.491 HG23 ' HD3' ' A' ' 12' ' ' LYS . 97.5 t -141.69 123.44 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 124.012 0.925 . . . . 72.51 109.594 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -101.31 109.99 21.92 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.209 0.604 . . . . 72.41 109.537 170.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.513 ' HG2' HG12 ' A' ' 40' ' ' ILE . 6.2 tmtm? -99.09 108.53 21.19 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 108.303 -0.999 . . . . 72.43 108.303 179.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -126.99 99.4 5.7 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.804 0.842 . . . . 73.41 110.413 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.04 -120.78 17.06 Favored Glycine 0 C--N 1.356 1.654 0 CA-C-N 115.322 -0.854 . . . . 73.23 112.641 176.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -77.05 -35.03 57.11 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.521 0.728 . . . . 74.31 110.654 178.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.474 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 89.5 m -87.95 126.39 35.03 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-O 121.319 0.58 . . . . 65.42 110.216 -175.502 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.513 HG12 ' HG2' ' A' ' 35' ' ' LYS . 33.3 mt -115.27 107.94 24.07 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 N-CA-C 107.836 -1.172 . . . . 75.41 107.836 173.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.57 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 94.4 mtt180 -83.31 131.62 35.07 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 123.905 0.882 . . . . 75.14 108.674 173.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.47 HG11 HG22 ' A' ' 33' ' ' VAL . 35.5 t -118.81 116.83 52.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 108.634 -0.876 . . . . 74.11 108.634 175.247 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.607 ' HG3' ' HG1' ' A' ' 56' ' ' THR . 4.6 mp0 -83.68 103.68 13.19 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 107.869 -1.159 . . . . 75.21 107.869 172.291 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.438 ' HG ' HG12 ' A' ' 42' ' ' VAL . 0.6 OUTLIER -109.6 166.85 10.58 Favored 'General case' 0 N--CA 1.484 1.235 0 N-CA-C 107.963 -1.125 . . . . 71.13 107.963 173.458 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -122.12 125.83 47.03 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.816 0.341 . . . . 73.24 110.255 -173.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.0 tt -96.85 115.57 27.66 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.911 1.284 . . . . 70.51 107.692 -177.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 . . . . . 0 N--CA 1.482 1.173 0 C-N-CA 123.962 0.905 . . . . 74.02 110.222 -177.739 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 83.8 tttt . . . . . 0 N--CA 1.467 0.41 0 N-CA-C 107.579 -1.267 . . . . 74.44 107.579 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -138.32 130.97 29.32 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.862 0.865 . . . . 63.13 109.78 -178.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 35.6 m-80 -83.4 127.23 33.51 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.352 0.661 . . . . 54.31 110.61 178.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -106.5 119.98 40.72 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.985 0.914 . . . . 72.44 109.351 176.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.607 ' HG1' ' HG3' ' A' ' 43' ' ' GLU . 80.5 m -86.7 101.7 13.53 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 124.762 1.225 . . . . 72.1 108.817 172.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.528 HG23 HG21 ' A' ' 71' ' ' ILE . 45.5 t -93.31 105.45 16.84 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 N-CA-C 108.437 -0.949 . . . . 73.15 108.437 179.124 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.57 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 33.6 mt-10 -77.94 112.15 14.54 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.796 0.839 . . . . 61.55 108.774 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.624 ' HB ' HG12 ' A' ' 11' ' ' VAL . 17.6 t -124.66 115.31 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 N-CA-C 108.573 -0.899 . . . . 72.2 108.573 177.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.474 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 29.4 tt0 -100.7 148.3 25.03 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.069 0.948 . . . . 74.34 110.233 -176.516 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.12 114.13 19.76 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 109.262 -0.644 . . . . 73.12 109.262 176.161 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 -119.81 86.61 2.59 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 124.275 1.03 . . . . 72.01 108.276 177.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 68.55 -132.37 27.17 Favored Glycine 0 C--N 1.346 1.101 0 CA-C-N 115.692 -0.685 . . . . 61.14 111.631 -175.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -80.59 -2.17 45.25 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.714 0.806 . . . . 55.13 111.721 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 73.8 p -114.56 150.96 34.16 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.084 0.554 . . . . 74.45 110.563 -176.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 96.3 m95 -98.32 119.18 36.55 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.056 0.942 . . . . 75.42 108.827 168.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 10.0 t -103.13 121.29 42.32 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.442 0.697 . . . . 75.32 109.875 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 51.2 t -76.29 106.97 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 108.494 -0.928 . . . . 75.22 108.494 176.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.454 ' HD3' ' HB3' ' A' ' 60' ' ' GLU . 1.5 mmmp? -65.02 -57.13 9.49 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 115.589 -0.732 . . . . 65.11 110.128 -179.352 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 63.1 ttt180 -167.26 136.25 2.71 Favored 'General case' 0 C--N 1.352 0.676 0 CA-C-N 116.008 -0.542 . . . . 75.24 110.597 178.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.528 HG21 HG23 ' A' ' 57' ' ' VAL . 71.9 mt -87.35 105.91 15.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 107.653 -1.24 . . . . 73.41 107.653 171.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 19.6 m -107.07 115.5 30.29 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.341 0.656 . . . . 75.54 109.506 -174.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -68.84 149.9 48.42 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.015 0.526 . . . . 71.52 109.753 172.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.8 t . . . . . 0 N--CA 1.475 0.798 0 C-N-CA 123.791 0.837 . . . . 73.51 110.202 167.431 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 . . . . . 0 CA--C 1.546 0.792 0 CA-C-O 120.571 0.224 . . . . 72.13 110.802 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -64.22 -40.96 97.14 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 116.196 -0.456 . . . . 74.33 111.097 177.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.543 ' HG3' HG12 ' A' ' 33' ' ' VAL . 1.0 OUTLIER -62.49 -42.41 99.48 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 123.713 0.633 . . . . 73.53 110.016 177.755 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 41.8 ttt180 -56.77 -44.31 81.7 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.776 0.831 . . . . 74.33 111.131 177.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.504 ' O ' HG21 ' A' ' 14' ' ' VAL . 46.4 mt-30 -68.92 -45.97 69.49 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 114.929 -1.032 . . . . 72.12 110.945 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.595 HG21 HD12 ' A' ' 40' ' ' ILE . 55.1 t -70.84 -43.47 76.96 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 124.065 0.946 . . . . 74.34 112.243 -173.44 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -61.66 -36.05 79.72 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.171 0.588 . . . . 71.34 110.168 176.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.505 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 8.8 tt0 -64.22 -52.51 58.47 Favored 'General case' 0 C--N 1.354 0.764 0 O-C-N 124.088 0.867 . . . . 74.41 110.21 176.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.516 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 84.9 t -55.25 -44.43 75.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 123.137 0.575 . . . . 63.54 110.22 178.057 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.01 -47.91 75.79 Favored 'General case' 0 C--O 1.248 1.017 0 C-N-CA 124.664 1.186 . . . . 63.43 112.52 -176.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.402 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 14.8 ptmm? -68.1 -35.8 78.74 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 115.564 -0.744 . . . . 71.31 110.854 -175.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.505 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 38.9 mm-40 -62.5 -40.09 95.58 Favored 'General case' 0 C--N 1.353 0.727 0 O-C-N 123.772 0.67 . . . . 74.14 111.25 179.191 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.516 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 13.9 mmmm -64.45 -40.14 95.16 Favored 'General case' 0 CA--C 1.551 1.008 0 O-C-N 123.425 0.453 . . . . 74.1 110.85 178.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.489 HD22 ' NE2' ' A' ' 22' ' ' GLN . 81.9 mt -71.74 -29.47 64.56 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.98 0.912 . . . . 72.14 112.42 177.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 90.4 mt -73.63 -33.72 64.67 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.44 0.696 . . . . 74.33 110.256 175.592 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 50.0 mt-10 -66.63 -31.75 72.63 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.527 0.731 . . . . 73.23 110.776 173.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.489 ' NE2' HD22 ' A' ' 19' ' ' LEU . 48.7 mt-30 -77.56 -41.14 40.03 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.324 0.65 . . . . 65.1 111.587 176.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.0 t -144.7 88.78 6.92 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 122.788 0.435 . . . . 75.44 110.085 -176.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -75.46 -15.93 19.48 Favored 'Trans proline' 0 C--N 1.38 2.202 0 C-N-CA 123.393 2.729 . . . . 54.23 113.153 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -81.79 -13.86 57.16 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.39 0.676 . . . . 74.54 110.601 174.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 67.2 m -98.11 137.56 36.7 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.241 0.617 . . . . 65.52 110.521 176.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -84.72 117.17 23.65 Favored 'General case' 0 C--O 1.243 0.724 0 N-CA-C 107.808 -1.182 . . . . 74.44 107.808 166.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 66.5 t -99.21 112.43 31.39 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 O-C-N 123.501 0.501 . . . . 74.4 109.876 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -97.62 178.01 5.31 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.01 0.924 . . . . 74.32 108.897 174.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.2 p -105.99 125.52 61.52 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 N-CA-C 109.624 -0.51 . . . . 74.01 109.624 173.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.8 tpt180 -83.08 -59.03 2.61 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 109.281 -0.636 . . . . 55.41 109.281 178.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 21.5 mtm180 -146.14 166.31 26.54 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.466 1.106 . . . . 74.14 109.74 176.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.543 HG12 ' HG3' ' A' ' 8' ' ' LYS . 60.9 t -130.02 111.59 21.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 N-CA-C 107.401 -1.333 . . . . 65.4 107.401 176.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 24.8 tp60 -107.41 109.93 21.77 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 118.008 0.367 . . . . 72.01 110.185 -177.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -78.29 137.14 37.93 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 108.626 -0.879 . . . . 65.32 108.626 170.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -143.55 82.65 1.74 Allowed 'General case' 0 C--O 1.242 0.662 0 N-CA-C 108.593 -0.892 . . . . 70.33 108.593 -177.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.54 -79.11 0.82 Allowed Glycine 0 C--N 1.348 1.242 0 CA-C-N 115.443 -0.799 . . . . 64.4 112.565 -178.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -131.98 -18.38 2.67 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.108 0.963 . . . . 72.01 110.994 174.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.521 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 7.0 m -85.21 116.74 23.74 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 122.78 0.432 . . . . 75.1 109.889 177.605 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.595 HD12 HG21 ' A' ' 11' ' ' VAL . 32.4 mt -91.0 106.35 17.44 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 N-CA-C 108.988 -0.745 . . . . 61.33 108.988 169.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.418 ' HA ' ' HA ' ' A' ' 58' ' ' GLU . 35.2 mtp180 -89.06 94.46 9.95 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 108.11 -1.07 . . . . 74.22 108.11 175.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.403 HG21 HG12 ' A' ' 11' ' ' VAL . 39.3 t -85.97 114.52 25.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 N-CA-C 108.971 -0.752 . . . . 75.24 108.971 -179.241 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -84.12 109.63 17.86 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 108.024 -1.102 . . . . 73.24 108.024 172.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.5 mp -104.04 169.08 8.71 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 122.974 0.509 . . . . 73.21 110.286 177.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 57.8 tt0 -121.2 105.29 10.44 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.174 0.989 . . . . 75.44 109.151 -175.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.2 tt -101.09 110.79 22.85 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 108.102 -1.073 . . . . 74.24 108.102 -177.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 72.4 mtt180 . . . . . 0 N--CA 1.478 0.967 0 C-N-CA 122.756 0.423 . . . . 74.53 110.806 -175.069 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt . . . . . 0 N--CA 1.474 0.765 0 N-CA-C 110.057 -0.349 . . . . 72.1 110.057 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -139.77 118.73 12.56 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 108.483 -0.932 . . . . 63.31 108.483 175.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -88.57 138.45 31.42 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 122.791 0.436 . . . . 73.31 111.355 -175.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -123.8 119.41 29.63 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.565 0.746 . . . . 75.43 109.209 178.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 28.2 m -86.42 100.13 12.13 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 109.391 -0.596 . . . . 74.1 109.391 175.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.456 HG21 HG22 ' A' ' 71' ' ' ILE . 45.9 t -93.31 104.21 15.49 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 N-CA-C 107.48 -1.304 . . . . 71.0 107.48 179.411 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.418 ' HA ' ' HA ' ' A' ' 41' ' ' ARG . 44.7 mt-10 -84.74 101.72 12.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.717 -1.129 . . . . 73.2 108.864 -176.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.51 ' HB ' HG11 ' A' ' 11' ' ' VAL . 21.6 t -106.65 111.26 34.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 124.067 0.947 . . . . 71.32 108.517 177.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.521 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 33.8 tt0 -100.97 150.13 23.2 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.523 0.729 . . . . 65.41 110.54 -175.165 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -68.16 106.28 2.36 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.355 0.662 . . . . 73.13 109.653 174.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 56.0 tp60 -92.83 85.96 5.35 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 108.43 -0.952 . . . . 73.35 108.43 173.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.02 -98.47 0.56 Allowed Glycine 0 C--N 1.348 1.244 0 N-CA-C 111.335 -0.706 . . . . 55.34 111.335 -174.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -101.53 -34.69 9.44 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.076 0.95 . . . . 75.11 109.98 176.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 65.0 p -84.87 175.97 8.78 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.827 0.851 . . . . 75.13 111.956 -174.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -114.05 139.39 49.33 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.565 1.146 . . . . 74.32 109.895 176.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 8.8 t -133.27 132.53 41.52 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.623 0.769 . . . . 73.44 110.109 -179.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.413 HG21 HG23 ' A' ' 59' ' ' VAL . 88.8 t -74.77 106.83 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 108.823 -0.806 . . . . 75.11 108.823 173.311 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.611 ' HB3' ' HZ1' ' A' ' 69' ' ' LYS . 2.9 mmmp? -63.46 -52.03 63.16 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.689 1.196 . . . . 74.22 109.857 175.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 19.1 tpt180 -175.67 144.43 0.65 Allowed 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.105 -0.952 . . . . 75.11 109.675 178.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.456 HG22 HG21 ' A' ' 57' ' ' VAL . 35.6 mt -88.38 110.56 21.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 N-CA-C 108.194 -1.039 . . . . 63.45 108.194 168.32 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 30.7 m -91.96 106.98 18.88 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.99 -0.745 . . . . 75.3 108.99 177.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 52.6 ttt180 -68.82 129.44 39.95 Favored 'General case' 0 C--O 1.244 0.816 0 N-CA-C 108.23 -1.026 . . . . 70.21 108.23 169.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 15.3 t . . . . . 0 C--O 1.246 0.889 0 O-C-N 123.774 0.671 . . . . 71.3 110.857 -179.683 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 . . . . . 0 CA--C 1.546 0.794 0 N-CA-C 111.209 0.077 . . . . 73.3 111.209 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -48.11 -53.57 16.17 Favored 'General case' 0 C--N 1.363 1.179 0 C-N-CA 124.074 0.949 . . . . 63.45 110.127 173.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.515 ' HG3' HG11 ' A' ' 33' ' ' VAL . 0.4 OUTLIER -56.22 -45.09 80.06 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 124.905 1.378 . . . . 74.51 109.732 -175.898 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -62.89 -38.12 89.63 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.97 0.908 . . . . 75.02 111.356 -177.27 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -75.02 -44.58 47.17 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.698 0.799 . . . . 72.44 110.9 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.44 HG22 HD11 ' A' ' 40' ' ' ILE . 90.6 t -76.41 -32.76 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.179 0.992 . . . . 74.31 112.301 -169.166 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.5 ' HZ1' ' HB2' ' A' ' 12' ' ' LYS . 9.1 mtmp? -61.32 -37.92 85.0 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 109.685 -0.487 . . . . 74.45 109.685 173.009 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.526 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 7.8 tt0 -67.54 -52.08 43.16 Favored 'General case' 0 C--N 1.352 0.717 0 O-C-N 124.248 0.968 . . . . 71.34 110.123 176.025 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.445 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 72.2 t -54.97 -39.88 51.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 123.223 0.609 . . . . 73.14 110.62 179.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.434 ' HA ' HG13 ' A' ' 57' ' ' VAL . . . -66.62 -48.42 69.55 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 115.363 -0.835 . . . . 74.11 112.078 -178.79 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -71.34 -34.9 70.94 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 123.713 0.633 . . . . 72.23 111.769 -174.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 20.7 mm-40 -61.63 -43.4 98.92 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 123.404 0.44 . . . . 75.4 110.623 -179.303 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.559 ' HG3' HG22 ' A' ' 68' ' ' VAL . 2.2 mmmp? -64.18 -42.79 96.55 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 123.759 0.662 . . . . 73.42 110.011 178.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.491 ' HB3' HD12 ' A' ' 46' ' ' LEU . 40.5 mt -63.0 -34.89 78.52 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.76 0.824 . . . . 75.32 112.563 177.515 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 85.1 mt -77.21 -26.41 52.7 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.389 0.676 . . . . 74.21 111.62 -177.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 12.5 mm-40 -69.87 -36.62 75.63 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 109.909 -0.404 . . . . 74.4 109.909 171.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -77.28 -31.37 54.77 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.312 1.045 . . . . 71.02 111.462 178.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.9 m -146.28 83.15 8.61 Favored Pre-proline 0 CA--C 1.56 1.35 0 C-N-CA 123.705 0.802 . . . . 72.14 109.935 -174.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -75.71 -21.26 14.75 Favored 'Trans proline' 0 C--N 1.375 1.951 0 C-N-CA 123.138 2.558 . . . . 64.41 112.127 177.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -86.57 15.28 5.71 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.326 1.05 . . . . 63.41 111.18 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 46.9 t -120.2 152.78 37.21 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.476 0.711 . . . . 71.51 111.207 -176.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.89 108.96 20.73 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 107.73 -1.211 . . . . 75.02 107.73 174.339 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.3 t -97.46 116.83 40.92 Favored 'Isoleucine or valine' 0 C--O 1.239 0.552 0 C-N-CA 123.508 0.723 . . . . 71.01 110.061 -176.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -101.59 161.94 13.27 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.578 1.151 . . . . 74.23 108.345 171.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 59.2 t -87.48 113.85 25.48 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 N-CA-C 107.834 -1.173 . . . . 73.54 107.834 169.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -81.89 -45.27 15.7 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.397 0.679 . . . . 73.41 110.111 -176.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 29.8 tpt180 -167.66 157.01 10.01 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 124.03 0.932 . . . . 70.24 109.145 177.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.515 HG11 ' HG3' ' A' ' 8' ' ' LYS . 58.0 t -120.87 130.58 74.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 123.464 0.706 . . . . 75.24 109.374 176.256 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.616 ' HB3' HE21 ' A' ' 36' ' ' GLN . 84.2 mm-40 -119.62 112.18 19.0 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.728 0.811 . . . . 75.13 109.706 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.559 ' HG2' HG12 ' A' ' 40' ' ' ILE . 3.6 tmtp? -92.06 107.4 19.18 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 106.747 -1.575 . . . . 74.01 106.747 173.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.616 HE21 ' HB3' ' A' ' 34' ' ' GLN . 83.6 mm-40 -119.55 101.58 8.03 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 108.522 -0.918 . . . . 75.5 108.522 -174.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.19 -93.72 0.52 Allowed Glycine 0 C--N 1.348 1.242 0 O-C-N 123.585 0.553 . . . . 40.33 112.488 -176.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -135.55 5.86 3.2 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.343 1.057 . . . . 64.03 109.26 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 69.3 m -118.67 116.16 26.01 Favored 'General case' 0 C--O 1.241 0.628 0 C-N-CA 124.69 1.196 . . . . 74.13 109.621 -177.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.559 HG12 ' HG2' ' A' ' 35' ' ' LYS . 35.0 mt -88.8 108.14 18.59 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-O 121.037 0.446 . . . . 75.11 110.119 178.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -86.17 95.22 9.5 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.403 1.081 . . . . 74.23 108.172 174.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 25.9 t -85.46 122.92 38.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 N-CA-C 109.13 -0.692 . . . . 61.33 109.13 178.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -87.24 121.21 29.39 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 108.007 -1.109 . . . . 75.13 108.007 170.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.8 mp -120.08 151.2 39.39 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-O 121.122 0.486 . . . . 73.12 109.917 179.289 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.486 ' HG3' ' HG3' ' A' ' 52' ' ' LYS . 39.3 tt0 -106.31 102.5 11.9 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 107.77 -1.196 . . . . 55.24 107.77 -179.648 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.491 HD12 ' HB3' ' A' ' 19' ' ' LEU . 8.8 tt -102.0 112.16 24.7 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.146 -1.057 . . . . 73.5 108.146 -174.558 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 . . . . . 0 N--CA 1.478 0.957 0 C-N-CA 123.273 0.629 . . . . 72.32 110.181 -169.513 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.486 ' HG3' ' HG3' ' A' ' 45' ' ' GLU . 39.8 ttmt . . . . . 0 C--O 1.245 0.838 0 N-CA-C 108.259 -1.015 . . . . 73.22 108.259 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -102.37 112.53 25.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.975 -1.011 . . . . 73.24 108.451 179.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.46 HD22 ' HG2' ' A' ' 52' ' ' LYS . 0.8 OUTLIER -92.0 115.2 27.86 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 109.058 -0.719 . . . . 73.32 109.058 -177.038 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -108.45 121.1 44.25 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.627 0.771 . . . . 63.31 109.359 179.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 35.0 m -90.93 100.83 13.62 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 108.265 -1.013 . . . . 75.43 108.265 169.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.444 HG11 HG12 ' A' ' 71' ' ' ILE . 47.3 t -93.66 103.41 14.66 Favored 'Isoleucine or valine' 0 C--O 1.241 0.656 0 N-CA-C 107.326 -1.361 . . . . 75.25 107.326 177.369 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -87.59 100.8 13.06 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.439 -0.8 . . . . 73.23 108.871 -176.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.439 HG21 HG21 ' A' ' 68' ' ' VAL . 25.5 t -104.45 116.1 47.62 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 124.113 0.965 . . . . 73.24 109.165 -177.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -100.78 143.53 30.83 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.246 1.018 . . . . 63.54 109.947 -175.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.7 tpp180 -71.36 134.19 46.52 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.163 0.585 . . . . 64.23 110.602 176.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -133.05 89.84 2.67 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 108.274 -1.01 . . . . 61.12 108.274 172.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 68.26 -111.26 3.89 Favored Glycine 0 C--N 1.35 1.323 0 CA-C-N 114.813 -1.085 . . . . 73.34 112.325 -177.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -92.26 -25.68 18.5 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.287 0.635 . . . . 74.11 111.089 178.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 22.9 p -99.12 175.76 5.79 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.917 0.887 . . . . 75.22 111.847 -175.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -123.57 158.52 31.22 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.522 1.129 . . . . 74.23 109.761 179.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 9.0 t -145.46 135.3 23.55 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.494 0.318 . . . . 72.2 110.725 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.559 HG22 ' HG3' ' A' ' 18' ' ' LYS . 91.3 t -77.86 115.47 19.89 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 N-CA-C 109.227 -0.657 . . . . 52.45 109.227 173.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -80.92 -41.89 22.24 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 123.24 0.616 . . . . 75.22 110.632 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -165.38 144.35 6.42 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 123.462 0.705 . . . . 73.35 110.261 175.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.444 HG12 HG11 ' A' ' 57' ' ' VAL . 41.8 mt -104.25 107.66 22.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 N-CA-C 108.027 -1.101 . . . . 73.24 108.027 168.322 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.0 m -107.76 108.39 19.58 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.204 0.602 . . . . 74.43 109.676 -178.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 -79.29 150.01 31.63 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 109.579 -0.526 . . . . 74.12 109.579 172.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.3 t . . . . . 0 CA--C 1.554 1.12 0 CA-C-N 115.656 -0.702 . . . . 73.11 109.951 172.544 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.426 ' HG3' HE21 ' A' ' 10' ' ' GLN . 13.2 tp10 . . . . . 0 N--CA 1.469 0.479 0 N-CA-C 110.085 -0.339 . . . . 74.4 110.085 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.544 ' O ' HG22 ' A' ' 11' ' ' VAL . 39.9 mm-40 -55.04 -45.91 75.26 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 124.258 0.974 . . . . 74.24 111.895 175.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -62.2 -36.57 82.33 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 122.898 0.479 . . . . 74.01 111.389 -178.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.413 ' HA ' ' HE3' ' A' ' 12' ' ' LYS . 43.5 mtp180 -63.73 -38.96 93.05 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 115.557 -0.747 . . . . 74.44 109.797 179.172 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.426 HE21 ' HG3' ' A' ' 6' ' ' GLU . 58.0 mt-30 -66.59 -40.93 89.13 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 114.753 -1.112 . . . . 73.12 110.875 176.342 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.544 HG22 ' O ' ' A' ' 7' ' ' GLU . 63.0 t -61.05 -44.78 98.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 123.434 0.694 . . . . 71.54 111.9 -175.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.567 ' HZ1' ' HB2' ' A' ' 12' ' ' LYS . 10.1 mtmp? -60.92 -32.69 72.17 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 123.732 0.645 . . . . 72.45 110.724 179.65 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.506 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.9 tt0 -71.68 -53.78 12.45 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 115.361 -0.836 . . . . 72.44 110.323 176.371 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.5 t -53.91 -36.27 30.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 C-N-CA 123.598 0.759 . . . . 74.14 110.759 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.448 ' HA ' HG13 ' A' ' 57' ' ' VAL . . . -66.85 -50.95 60.9 Favored 'General case' 0 C--O 1.247 0.924 0 CA-C-N 114.795 -1.093 . . . . 73.32 111.454 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.435 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 20.5 ptmt -69.46 -33.08 72.38 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 116.18 -0.464 . . . . 73.23 111.925 -175.133 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.506 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 19.3 mm-40 -61.86 -43.0 99.72 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 123.691 0.619 . . . . 74.01 110.122 -179.114 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.433 ' HG3' HG22 ' A' ' 68' ' ' VAL . 14.9 mmmm -73.88 -22.43 59.73 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 115.603 -0.726 . . . . 64.52 111.143 -178.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 57.9 mt -73.9 -36.22 64.73 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 122.852 0.461 . . . . 70.41 111.541 169.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 83.6 mt -66.12 -32.15 73.44 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.627 0.771 . . . . 64.51 110.77 178.445 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -57.19 -41.31 79.08 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.918 0.887 . . . . 74.14 110.962 174.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -80.75 -51.72 8.34 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.488 -0.778 . . . . 73.2 110.824 -177.003 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 27.1 t -131.11 89.4 42.14 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 123.277 0.631 . . . . 72.03 109.927 -175.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -80.06 -1.93 11.73 Favored 'Trans proline' 0 C--N 1.375 1.965 0 C-N-CA 122.989 2.459 . . . . 73.41 112.592 174.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -86.56 6.55 30.19 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.964 0.906 . . . . 75.31 111.832 -178.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 21.5 p -143.72 141.98 30.73 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.514 0.726 . . . . 71.11 110.644 -171.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -86.72 136.63 32.94 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 108.342 -0.985 . . . . 73.13 108.342 174.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.506 HG22 HD11 ' A' ' 46' ' ' LEU . 40.7 t -98.61 117.18 43.21 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 C-N-CA 123.114 0.566 . . . . 73.45 110.236 -174.069 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 54.4 tp60 -91.71 147.57 22.9 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.806 1.243 . . . . 75.21 109.168 175.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 79.9 t -87.92 121.2 38.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 N-CA-C 108.343 -0.984 . . . . 61.54 108.343 170.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.3 tpt180 -94.72 -59.62 1.88 Allowed 'General case' 0 N--CA 1.477 0.88 0 O-C-N 123.295 0.372 . . . . 74.31 110.242 -178.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 50.3 mtt180 -148.53 165.2 31.93 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 124.321 1.048 . . . . 74.43 110.166 -179.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 82.0 t -137.16 132.78 46.87 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 C-N-CA 124.346 1.059 . . . . 73.24 109.127 178.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.409 ' HB2' ' HB2' ' A' ' 41' ' ' ARG . 69.2 mm-40 -125.46 108.57 11.76 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.332 1.053 . . . . 73.5 108.814 -177.213 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.5 tmtt? -92.87 106.92 18.81 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 108.042 -1.096 . . . . 73.54 108.042 -176.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.2 mm-40 -120.51 89.01 3.04 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.443 0.697 . . . . 74.05 109.791 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.6 -98.58 0.41 Allowed Glycine 0 C--N 1.35 1.339 0 CA-C-N 115.598 -0.728 . . . . 72.33 112.501 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.417 HD21 ' HB3' ' A' ' 61' ' ' ARG . 16.7 m120 -105.87 -26.16 11.84 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.738 0.815 . . . . 70.12 110.349 175.125 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 25.1 m -87.77 98.68 11.59 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.406 0.683 . . . . 74.31 110.475 -177.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.515 HD12 HG21 ' A' ' 11' ' ' VAL . 40.1 mt -90.12 108.47 19.51 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 CA-C-N 116.085 -0.507 . . . . 75.21 109.867 171.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.581 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 91.6 mtt180 -84.12 105.8 15.27 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.402 1.081 . . . . 70.42 109.388 174.44 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.1 t -95.19 118.94 42.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 N-CA-C 108.721 -0.844 . . . . 63.43 108.721 174.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.466 ' HG3' ' HG1' ' A' ' 56' ' ' THR . 3.8 mp0 -83.74 115.24 22.11 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 107.992 -1.114 . . . . 75.13 107.992 168.271 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.7 mp -108.71 170.83 7.78 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.887 -0.783 . . . . 63.23 108.887 174.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -135.75 107.68 7.11 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.862 -0.792 . . . . 74.52 108.862 -168.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.506 HD11 HG22 ' A' ' 28' ' ' VAL . 9.2 tt -127.71 138.15 52.69 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.831 1.252 . . . . 75.44 108.697 -168.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 48.9 mtm105 . . . . . 0 N--CA 1.478 0.94 0 C-N-CA 122.828 0.451 . . . . 75.23 110.923 -175.421 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.543 0.701 0 N-CA-C 108.209 -1.034 . . . . 64.23 108.209 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -120.51 127.82 52.54 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.773 1.229 . . . . 74.22 109.091 178.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -88.58 130.02 35.35 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 109.163 -0.681 . . . . 73.33 109.163 175.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -114.22 118.71 34.74 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 109.279 -0.637 . . . . 72.45 109.279 178.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.466 ' HG1' ' HG3' ' A' ' 43' ' ' GLU . 38.4 m -86.16 100.7 12.4 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 108.458 -0.942 . . . . 75.42 108.458 172.367 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.448 HG13 ' HA ' ' A' ' 15' ' ' ALA . 60.1 t -92.91 106.52 18.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 N-CA-C 108.411 -0.959 . . . . 74.23 108.411 178.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.581 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 33.1 mt-10 -77.31 107.6 9.83 Favored 'General case' 0 C--O 1.222 -0.353 0 N-CA-C 108.056 -1.09 . . . . 63.51 108.056 178.213 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.507 HG23 HG21 ' A' ' 68' ' ' VAL . 38.8 t -112.14 124.38 68.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 N-CA-C 109.006 -0.739 . . . . 75.43 109.006 176.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -112.92 147.51 36.92 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.499 0.719 . . . . 72.24 110.128 -177.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.417 ' HB3' HD21 ' A' ' 38' ' ' ASN . 9.8 tpt180 -74.96 106.78 6.63 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.372 -0.831 . . . . 75.23 110.357 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 22.7 tp60 -91.22 79.12 5.73 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 108.388 -0.968 . . . . 75.0 108.388 174.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 73.24 -100.53 1.05 Allowed Glycine 0 C--N 1.348 1.215 0 CA-C-N 114.986 -1.006 . . . . 74.33 112.366 -179.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -95.0 -32.2 13.26 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.142 0.977 . . . . 62.22 110.265 176.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.8 p -96.08 176.46 6.08 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.687 0.795 . . . . 71.14 111.358 -175.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . 0.407 ' HZ2' ' HB3' ' A' ' 7' ' ' GLU . 96.3 m95 -119.08 149.07 42.3 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.844 1.258 . . . . 72.5 109.934 179.21 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 14.9 t -147.92 140.19 24.31 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.276 0.63 . . . . 65.32 110.281 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.507 HG21 HG23 ' A' ' 59' ' ' VAL . 76.4 t -80.78 114.15 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 123.047 0.539 . . . . 73.24 110.815 -177.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -65.41 -54.75 24.18 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.743 1.217 . . . . 74.41 110.85 175.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 2.3 tpm_? -163.36 132.18 3.92 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.608 -0.723 . . . . 74.23 110.012 -178.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 63.5 mt -87.76 107.4 17.29 Favored 'Isoleucine or valine' 0 C--O 1.24 0.568 0 N-CA-C 107.828 -1.175 . . . . 70.35 107.828 167.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 22.2 m -98.48 115.5 28.68 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.112 -0.949 . . . . 74.43 108.773 -178.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 11.8 ttm180 -69.49 149.31 48.4 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 108.883 -0.784 . . . . 75.43 108.883 171.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 8.1 t . . . . . 0 C--O 1.245 0.867 0 C-N-CA 123.0 0.52 . . . . 73.44 110.307 173.495 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 . . . . . 0 N--CA 1.48 1.046 0 N-CA-C 111.822 0.305 . . . . 64.4 111.822 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -46.28 -53.23 11.11 Favored 'General case' 0 C--O 1.209 -1.037 0 C-N-CA 123.764 0.825 . . . . 74.52 109.948 165.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.647 ' HG3' HG12 ' A' ' 33' ' ' VAL . 1.1 mptm? -58.57 -45.34 89.2 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.312 1.045 . . . . 75.14 111.208 179.478 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 28.3 mmm180 -55.97 -42.24 75.98 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.857 0.863 . . . . 75.23 110.881 -177.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -78.57 -55.13 5.44 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 114.773 -1.103 . . . . 52.34 111.34 -178.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.406 HG22 HD12 ' A' ' 40' ' ' ILE . 73.9 t -65.81 -37.58 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 124.842 1.257 . . . . 73.24 113.218 -166.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.459 ' HG3' ' O ' ' A' ' 8' ' ' LYS . 22.3 mtmm -64.01 -38.12 89.92 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-N 118.163 0.438 . . . . 75.41 109.903 178.463 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.529 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.5 tt0 -69.05 -45.53 70.18 Favored 'General case' 0 C--N 1.352 0.679 0 CA-C-N 115.349 -0.841 . . . . 64.44 110.494 178.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.475 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 92.8 t -60.19 -41.51 86.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 123.228 0.611 . . . . 73.44 109.99 177.205 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.76 -39.08 76.92 Favored 'General case' 0 C--O 1.244 0.769 0 C-N-CA 124.213 1.005 . . . . 75.51 111.927 -176.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.438 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 21.6 ptmt -71.87 -30.89 65.9 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 119.297 -0.383 . . . . 62.12 110.566 -179.128 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.529 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 24.4 mm-40 -61.91 -41.77 98.31 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 123.609 0.568 . . . . 74.44 110.4 174.232 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.54 ' HB3' HD12 ' A' ' 71' ' ' ILE . 2.1 mmmp? -61.41 -36.54 80.6 Favored 'General case' 0 CA--C 1.55 0.948 0 O-C-N 124.048 0.842 . . . . 73.34 110.507 178.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.585 ' HB3' HD11 ' A' ' 46' ' ' LEU . 52.0 mt -76.07 -31.91 59.0 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.788 0.835 . . . . 75.34 112.436 177.276 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 93.3 mt -73.11 -25.44 60.86 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.987 0.515 . . . . 62.44 110.902 178.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.462 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 49.5 mt-10 -65.11 -42.71 93.71 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-O 121.293 0.568 . . . . 73.1 110.149 171.82 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -71.37 -36.3 71.4 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 115.044 -0.98 . . . . 71.53 111.238 178.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.2 t -148.88 89.75 4.91 Favored Pre-proline 0 CA--C 1.544 0.716 0 CA-C-N 115.836 -0.62 . . . . 71.24 109.688 -175.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -70.37 -17.46 34.78 Favored 'Trans proline' 0 C--N 1.377 2.034 0 C-N-CA 122.828 2.352 . . . . 74.35 111.609 172.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -79.59 -10.73 59.85 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.338 1.055 . . . . 61.43 112.099 -176.315 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 68.7 p -104.8 157.0 17.5 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.514 0.726 . . . . 72.1 111.672 -178.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.482 ' HE3' ' HA ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -102.86 124.18 47.91 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 108.353 -0.98 . . . . 74.31 108.353 164.626 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 49.4 t -101.4 114.22 39.96 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 123.796 0.838 . . . . 72.54 109.958 -178.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -93.53 165.11 12.91 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 124.322 1.049 . . . . 74.31 108.693 171.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.453 HG23 ' HD2' ' A' ' 12' ' ' LYS . 4.0 p -81.92 132.5 31.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 N-CA-C 109.0 -0.741 . . . . 74.41 109.0 165.203 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 -100.93 -44.21 5.82 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.362 0.665 . . . . 74.22 109.933 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -167.67 151.02 6.11 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 108.024 -1.102 . . . . 72.43 108.024 -175.039 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.647 HG12 ' HG3' ' A' ' 8' ' ' LYS . 65.8 t -129.62 130.77 67.11 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 123.487 0.715 . . . . 60.33 109.297 176.163 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -121.88 108.11 13.07 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.06 0.944 . . . . 70.11 109.801 177.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -92.17 109.68 21.05 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 108.395 -0.965 . . . . 74.34 108.395 171.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -122.52 90.13 3.24 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.768 0.827 . . . . 73.03 109.598 -178.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.26 -85.38 0.1 Allowed Glycine 0 C--N 1.348 1.2 0 CA-C-N 115.78 -0.645 . . . . 54.53 114.218 173.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -118.2 4.44 11.95 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 124.303 1.041 . . . . 64.0 111.869 -176.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 47.5 m -142.18 119.47 11.51 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.815 0.446 . . . . 62.15 111.043 -174.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.406 HD12 HG22 ' A' ' 11' ' ' VAL . 24.5 mt -94.75 108.12 20.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 123.171 0.588 . . . . 73.35 109.758 171.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 11.9 mtm180 -90.12 99.98 12.89 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 107.365 -1.346 . . . . 74.31 107.365 174.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.428 HG11 HG21 ' A' ' 33' ' ' VAL . 40.5 t -91.07 116.53 32.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 N-CA-C 108.911 -0.774 . . . . 75.35 108.911 178.228 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -79.15 127.04 31.52 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 107.652 -1.24 . . . . 74.31 107.652 167.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.8 mp -124.22 154.42 40.18 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 109.386 -0.598 . . . . 74.01 109.386 177.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -107.27 104.5 14.13 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 108.932 -0.766 . . . . 74.43 108.932 -177.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.585 HD11 ' HB3' ' A' ' 19' ' ' LEU . 9.5 tt -100.76 126.53 47.32 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 108.244 -1.021 . . . . 64.21 108.244 -178.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 . . . . . 0 N--CA 1.485 1.282 0 C-N-CA 122.884 0.473 . . . . 74.14 110.949 -173.672 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt . . . . . 0 N--CA 1.468 0.468 0 N-CA-C 109.313 -0.625 . . . . 72.52 109.313 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -145.29 127.87 16.1 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 108.597 -0.89 . . . . 62.04 108.597 174.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.453 ' N ' HD21 ' A' ' 54' ' ' ASN . 0.7 OUTLIER -86.85 143.04 27.63 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.975 0.91 . . . . 74.53 109.3 -178.529 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -132.07 120.25 22.11 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.018 0.527 . . . . 72.43 110.007 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 91.0 m -84.98 100.29 11.56 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 108.825 -0.805 . . . . 63.35 108.825 170.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 71.2 t -93.02 103.86 15.12 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 N-CA-C 107.047 -1.464 . . . . 71.24 107.047 174.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.424 ' HB2' ' HB2' ' A' ' 69' ' ' LYS . 41.1 mt-10 -79.41 114.58 18.46 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 114.917 -1.038 . . . . 75.34 108.583 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 44.5 t -115.73 122.2 68.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 124.047 0.939 . . . . 75.11 108.61 177.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.462 ' HB2' ' HD3' ' A' ' 69' ' ' LYS . 35.9 tt0 -100.59 144.68 29.28 Favored 'General case' 0 C--O 1.241 0.653 0 C-N-CA 124.426 1.09 . . . . 75.12 109.827 -173.399 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 26.0 tpt180 -80.73 105.5 12.01 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.388 0.675 . . . . 75.42 109.447 174.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -108.12 89.47 3.01 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.375 1.07 . . . . 73.41 108.208 179.079 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 71.0 -107.51 2.19 Favored Glycine 0 CA--C 1.529 0.965 0 N-CA-C 111.693 -0.563 . . . . 71.44 111.693 -174.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -113.6 -3.57 13.6 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.882 0.873 . . . . 73.43 109.99 174.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 32.8 p -99.02 172.55 7.33 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.329 0.585 . . . . 74.3 111.096 176.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -119.49 140.72 50.02 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.876 1.27 . . . . 71.23 109.227 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 9.0 t -140.28 124.32 17.54 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 121.196 0.522 . . . . 73.32 110.453 -178.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 90.0 t -75.28 114.36 15.24 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 C-N-CA 123.287 0.635 . . . . 73.21 110.17 -177.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.462 ' HD3' ' HB2' ' A' ' 60' ' ' GLU . 32.1 mmmt -64.93 -50.4 66.61 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.626 1.171 . . . . 62.35 110.43 176.208 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -170.37 165.1 8.8 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 124.508 1.13 . . . . 72.45 110.035 175.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.54 HD12 ' HB3' ' A' ' 18' ' ' LYS . 75.1 mt -101.44 107.22 20.99 Favored 'Isoleucine or valine' 0 C--O 1.24 0.593 0 N-CA-C 107.491 -1.299 . . . . 70.42 107.491 166.038 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 12.3 m -92.87 114.58 27.18 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 109.299 -0.63 . . . . 75.11 109.299 -178.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 -68.05 141.47 56.16 Favored 'General case' 0 C--O 1.245 0.816 0 N-CA-C 109.037 -0.727 . . . . 74.2 109.037 169.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.5 t . . . . . 0 C--O 1.245 0.845 0 N-CA-C 109.112 -0.699 . . . . 71.21 109.112 173.993 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 . . . . . 0 CA--C 1.535 0.38 0 CA-C-O 119.664 -0.208 . . . . 73.23 111.138 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -56.69 -44.08 81.13 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.333 0.653 . . . . 62.33 110.309 174.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.4 ' O ' ' HG3' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -64.67 -45.47 86.58 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 124.059 0.849 . . . . 75.03 108.977 177.592 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 21.7 mtm180 -58.25 -40.02 80.68 Favored 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 123.866 0.866 . . . . 75.54 111.649 -178.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -67.57 -55.12 14.66 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.128 0.971 . . . . 74.01 110.314 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.574 HG22 HD12 ' A' ' 40' ' ' ILE . 72.4 t -64.97 -36.31 77.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 123.811 0.844 . . . . 75.3 112.436 -172.504 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.633 ' HZ3' ' HB2' ' A' ' 12' ' ' LYS . 10.3 mtmp? -65.4 -42.63 92.39 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.658 0.383 . . . . 72.11 110.26 176.362 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.495 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.2 tt0 -66.09 -49.29 68.1 Favored 'General case' 0 C--N 1.352 0.691 0 O-C-N 123.866 0.729 . . . . 64.14 110.217 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.475 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 84.6 t -57.87 -46.23 87.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 123.232 0.613 . . . . 74.43 109.862 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.467 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -60.25 -51.61 68.84 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.77 0.828 . . . . 62.2 112.295 -178.305 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -63.4 -39.5 94.67 Favored 'General case' 0 C--N 1.351 0.633 0 O-C-N 123.924 0.765 . . . . 73.32 110.406 -178.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 33.4 mm-40 -66.59 -40.66 89.0 Favored 'General case' 0 C--N 1.353 0.748 0 O-C-N 123.409 0.443 . . . . 74.4 110.975 178.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 73.4 mmtt -64.17 -35.31 80.38 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.484 0.714 . . . . 65.12 110.95 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.601 ' HB3' HD13 ' A' ' 46' ' ' LEU . 61.5 mt -75.5 -30.44 59.85 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.627 -0.715 . . . . 75.11 111.545 175.686 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.0 mt -73.29 -28.4 62.09 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.523 0.729 . . . . 72.5 110.978 174.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 24.4 mm-40 -59.24 -36.35 75.29 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 123.29 0.636 . . . . 75.32 110.172 174.458 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -91.83 -30.4 16.22 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 114.444 -1.253 . . . . 74.1 111.199 -175.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.2 t -148.81 88.33 5.24 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 122.82 0.448 . . . . 52.14 110.685 -175.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -76.04 -20.91 14.46 Favored 'Trans proline' 0 C--N 1.383 2.359 0 C-N-CA 123.155 2.57 . . . . 75.42 113.367 178.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -78.31 -13.18 59.96 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.346 0.658 . . . . 74.11 111.733 -176.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 54.0 p -105.87 135.5 47.18 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.577 0.751 . . . . 71.34 110.487 177.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -75.06 126.61 31.38 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 108.708 -0.849 . . . . 73.34 108.708 167.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 58.6 t -100.85 112.91 35.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 109.421 -0.585 . . . . 75.2 109.421 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.505 ' HB2' ' HB3' ' A' ' 45' ' ' GLU . 15.8 mm100 -100.0 123.76 44.61 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.909 1.284 . . . . 75.12 109.397 -178.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 p -64.88 115.78 3.52 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 N-CA-C 109.121 -0.696 . . . . 74.14 109.121 173.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 -96.53 -42.14 8.22 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.716 -0.675 . . . . 73.05 110.25 -171.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.474 ' HB3' ' HB2' ' A' ' 43' ' ' GLU . 60.6 ttt180 -154.71 143.79 21.05 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.463 0.705 . . . . 75.14 110.181 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.8 t -114.63 110.69 32.97 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 N-CA-C 107.982 -1.118 . . . . 71.31 107.982 173.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 23.7 tp60 -125.7 117.07 22.69 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 118.162 0.437 . . . . 74.44 111.308 -174.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.6 tppp? -78.23 134.66 37.55 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.905 0.882 . . . . 54.41 110.59 178.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.8 mm-40 -128.43 84.05 2.21 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.365 1.066 . . . . 73.53 108.331 170.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.43 -93.18 0.7 Allowed Glycine 0 C--N 1.35 1.344 0 CA-C-N 115.83 -0.623 . . . . 74.24 111.618 -175.312 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.488 ' HB3' ' HB3' ' A' ' 61' ' ' ARG . 3.9 m-20 -119.27 -13.07 9.34 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 123.557 0.743 . . . . 65.23 110.299 173.3 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.622 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 21.2 m -91.84 99.25 12.15 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 123.685 0.794 . . . . 72.04 110.177 -179.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.574 HD12 HG22 ' A' ' 11' ' ' VAL . 37.9 mt -76.55 107.77 8.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 N-CA-C 108.988 -0.745 . . . . 74.3 108.988 175.071 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.448 HH21 HG23 ' A' ' 56' ' ' THR . 54.0 mtp180 -83.68 95.4 8.37 Favored 'General case' 0 C--O 1.24 0.603 0 N-CA-C 107.508 -1.293 . . . . 73.22 107.508 169.133 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.4 HG23 ' HB3' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -85.02 123.31 39.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 N-CA-C 108.685 -0.857 . . . . 71.44 108.685 173.948 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.474 ' HB2' ' HB3' ' A' ' 32' ' ' ARG . 45.0 mt-10 -89.33 130.51 35.7 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 123.943 0.897 . . . . 63.23 108.748 170.367 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.2 mp -130.2 168.68 16.44 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.214 0.53 . . . . 72.24 110.108 179.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.505 ' HB3' ' HB2' ' A' ' 29' ' ' GLN . 31.1 tt0 -118.24 119.33 34.36 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 125.455 1.502 . . . . 73.32 108.508 -174.177 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.601 HD13 ' HB3' ' A' ' 19' ' ' LEU . 8.1 tt -133.36 129.85 38.01 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.077 -1.453 . . . . 75.14 107.077 -176.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 50.8 mtp180 . . . . . 0 CA--C 1.54 0.589 0 C-N-CA 123.147 0.579 . . . . 74.43 109.882 -175.827 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt . . . . . 0 N--CA 1.475 0.808 0 CA-C-O 120.69 0.281 . . . . 74.51 111.172 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.533 ' HG2' ' HD2' ' A' ' 73' ' ' ARG . 13.2 mp0 -105.11 143.37 33.38 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.055 0.942 . . . . 62.32 110.299 179.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -93.96 131.63 39.22 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 108.949 -0.76 . . . . 74.42 108.949 173.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.526 ' CE2' ' HB3' ' A' ' 46' ' ' LEU . 20.9 m-85 -120.44 121.45 38.55 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.535 0.734 . . . . 74.41 109.726 178.466 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.448 HG23 HH21 ' A' ' 41' ' ' ARG . 25.1 m -87.63 103.88 15.99 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.757 0.823 . . . . 45.33 109.455 173.56 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.467 HG11 ' HA ' ' A' ' 15' ' ' ALA . 48.9 t -93.74 105.26 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 N-CA-C 107.55 -1.278 . . . . 54.45 107.55 172.621 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -88.49 100.11 12.81 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 108.407 -0.961 . . . . 64.03 108.407 -177.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.579 HG23 HG21 ' A' ' 68' ' ' VAL . 29.1 t -104.03 118.92 51.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 123.792 0.837 . . . . 64.34 108.948 -178.63 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.622 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 31.0 tt0 -101.07 146.47 27.4 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.089 0.956 . . . . 64.44 110.114 -177.432 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.488 ' HB3' ' HB3' ' A' ' 38' ' ' ASN . 7.7 tpp180 -74.31 142.16 45.21 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 116.158 -0.474 . . . . 71.11 110.106 173.416 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -142.61 83.3 1.81 Allowed 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 108.123 -1.066 . . . . 71.21 108.123 175.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.21 -104.07 1.2 Allowed Glycine 0 C--N 1.345 1.08 0 CA-C-N 115.33 -0.85 . . . . 62.44 112.032 -176.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -101.84 -19.18 15.41 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.123 0.569 . . . . 74.43 111.091 179.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.6 t -100.25 172.9 6.88 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 122.869 0.468 . . . . 74.1 111.319 -176.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -123.08 120.96 34.83 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.605 1.162 . . . . 74.44 109.208 179.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.9 t -111.97 120.5 42.12 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 123.918 0.887 . . . . 72.41 110.484 179.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.579 HG21 HG23 ' A' ' 59' ' ' VAL . 58.9 t -74.81 120.18 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 N-CA-C 109.68 -0.489 . . . . 70.15 109.68 179.092 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.415 ' HA ' ' HE2' ' A' ' 69' ' ' LYS . 11.5 mmpt? -76.59 -55.59 5.38 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.394 1.077 . . . . 71.21 110.923 -179.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 23.2 ttt85 -163.68 125.73 2.46 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.687 -0.688 . . . . 75.3 110.412 -172.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.43 HD13 ' HB3' ' A' ' 18' ' ' LYS . 57.1 mt -93.35 131.05 41.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 N-CA-C 107.917 -1.142 . . . . 73.04 107.917 167.5 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 84.7 m -137.91 125.48 22.14 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 123.516 0.726 . . . . 64.12 109.689 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.533 ' HD2' ' HG2' ' A' ' 53' ' ' GLU . 36.7 ttp85 -75.37 144.65 42.19 Favored 'General case' 0 C--O 1.242 0.701 0 N-CA-C 108.43 -0.952 . . . . 72.14 108.43 170.126 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.3 t . . . . . 0 C--O 1.249 1.073 0 C-N-CA 123.478 0.711 . . . . 73.24 109.55 172.516 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 . . . . . 0 N--CA 1.479 1.005 0 N-CA-C 109.912 -0.403 . . . . 73.22 109.912 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.511 ' O ' HG23 ' A' ' 11' ' ' VAL . 29.6 mm-40 -67.48 -49.47 63.4 Favored 'General case' 0 C--N 1.35 0.599 0 CA-C-O 118.604 -0.712 . . . . 75.3 110.413 -179.503 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.663 ' HG3' HD11 ' A' ' 40' ' ' ILE . 4.0 mppt? -57.16 -37.33 71.92 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-N 118.228 0.467 . . . . 54.3 111.321 175.267 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.563 ' HA ' ' HE2' ' A' ' 12' ' ' LYS . 77.0 ttt180 -59.51 -43.53 93.37 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 123.642 0.589 . . . . 75.05 110.772 177.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.47 ' O ' HG21 ' A' ' 14' ' ' VAL . 48.8 mt-30 -64.76 -43.67 92.57 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 115.122 -0.945 . . . . 72.23 110.53 175.203 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 7' ' ' GLU . 74.7 t -62.81 -39.07 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 C-N-CA 124.499 1.12 . . . . 73.5 111.961 -176.27 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.563 ' HE2' ' HA ' ' A' ' 9' ' ' ARG . 49.7 mtmt -64.55 -36.16 83.31 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.291 0.637 . . . . 63.4 110.57 178.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.513 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.6 tt0 -67.09 -49.11 66.1 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 124.067 0.854 . . . . 73.31 109.889 175.399 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.47 HG21 ' O ' ' A' ' 10' ' ' GLN . 61.3 t -59.06 -32.42 47.81 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 123.387 0.675 . . . . 74.11 110.571 178.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.474 ' HA ' HG13 ' A' ' 57' ' ' VAL . . . -73.15 -49.36 28.68 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.254 1.021 . . . . 65.32 111.975 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -68.95 -36.64 78.15 Favored 'General case' 0 N--CA 1.479 1.008 0 O-C-N 123.753 0.658 . . . . 75.43 111.416 -173.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.513 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 16.0 mm-40 -64.65 -39.76 94.27 Favored 'General case' 0 C--N 1.353 0.719 0 O-C-N 123.711 0.632 . . . . 74.11 110.821 -177.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -73.76 -29.92 62.49 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.122 0.569 . . . . 75.13 111.52 -178.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.515 HD21 ' NE2' ' A' ' 22' ' ' GLN . 64.7 mt -71.09 -32.17 68.73 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.041 0.537 . . . . 62.5 111.41 171.215 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.9 mt -71.02 -32.42 69.18 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.306 0.642 . . . . 72.33 110.222 173.091 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 21.8 mm-40 -61.86 -44.53 96.64 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.147 0.579 . . . . 71.24 110.306 176.08 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.515 ' NE2' HD21 ' A' ' 19' ' ' LEU . 48.0 mt-30 -71.01 -42.91 68.96 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.109 -0.95 . . . . 61.34 111.457 -179.147 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.9 t -138.82 91.74 11.62 Favored Pre-proline 0 C--O 1.241 0.632 0 CA-C-N 116.03 -0.532 . . . . 74.11 110.483 -177.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -72.33 -12.38 27.45 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 122.925 2.417 . . . . 73.33 111.539 165.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -69.98 -25.06 63.44 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 124.685 1.194 . . . . 73.32 111.236 177.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 7.4 m -116.95 146.25 43.11 Favored 'General case' 0 C--O 1.239 0.548 0 C-N-CA 123.705 0.802 . . . . 73.23 110.758 -176.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -94.65 120.94 35.67 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 107.648 -1.242 . . . . 61.35 107.648 172.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 47.6 t -97.56 135.42 32.01 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 C-N-CA 123.812 0.845 . . . . 74.35 109.481 -173.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 54.8 tp60 -130.99 133.69 46.02 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.449 0.7 . . . . 73.31 109.312 -178.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.542 HG13 ' HD2' ' A' ' 12' ' ' LYS . 53.5 t -59.95 118.84 3.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 123.101 0.561 . . . . 75.13 110.463 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.412 ' H ' ' HA ' ' A' ' 44' ' ' LEU . 26.3 tpt180 -90.4 -49.47 6.5 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.514 0.726 . . . . 73.21 109.701 -173.253 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 18.8 ttt180 -160.86 151.39 18.13 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.845 0.858 . . . . 61.14 109.774 -178.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.404 HG23 ' HD3' ' A' ' 12' ' ' LYS . 64.1 t -114.97 128.43 72.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 123.62 0.768 . . . . 75.02 109.214 173.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -117.22 137.6 52.26 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 124.677 1.191 . . . . 72.11 107.897 176.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -107.54 119.99 40.95 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 107.364 -1.347 . . . . 74.31 107.364 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -130.7 75.66 1.67 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.714 0.806 . . . . 71.33 108.882 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 63.02 -114.48 6.94 Favored Glycine 0 C--N 1.348 1.21 0 CA-C-N 114.932 -1.031 . . . . 51.53 112.724 -178.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -82.89 -21.16 34.32 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.111 0.565 . . . . 74.12 110.906 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.446 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 24.7 m -100.62 104.22 15.54 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.704 0.801 . . . . 73.22 110.67 -178.628 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.663 HD11 ' HG3' ' A' ' 8' ' ' LYS . 77.9 mt -83.77 109.12 16.91 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 N-CA-C 108.806 -0.812 . . . . 73.14 108.806 172.598 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.576 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 64.2 mtt180 -88.84 95.46 10.3 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.133 0.973 . . . . 70.5 110.045 -179.328 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 57.0 t -87.92 110.71 21.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 N-CA-C 109.08 -0.711 . . . . 72.23 109.08 176.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.452 ' HG2' ' HG1' ' A' ' 56' ' ' THR . 42.3 mt-10 -76.43 134.1 39.68 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 109.429 -0.582 . . . . 73.24 109.429 169.122 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.412 ' HA ' ' H ' ' A' ' 31' ' ' ARG . 4.3 mp -131.78 168.4 17.87 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.058 0.543 . . . . 72.05 109.803 174.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -110.17 130.15 55.59 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 107.615 -1.254 . . . . 72.43 107.615 -179.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.61 ' HB3' ' CE2' ' A' ' 55' ' ' TYR . 6.8 tt -139.74 135.66 33.35 Favored 'General case' 0 C--O 1.249 1.057 0 N-CA-C 106.472 -1.677 . . . . 73.12 106.472 -179.516 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 83.1 mtt180 . . . . . 0 CA--C 1.536 0.412 0 CA-C-N 115.448 -0.796 . . . . 74.02 110.557 -166.965 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.571 ' HZ1' ' HB3' ' A' ' 52' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.238 0.48 0 N-CA-C 109.814 -0.439 . . . . 75.43 109.814 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 14.5 mp0 -129.6 139.31 51.5 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.346 0.658 . . . . 70.13 109.722 170.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -92.56 122.55 35.09 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.913 0.885 . . . . 64.13 109.181 172.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.61 ' CE2' ' HB3' ' A' ' 46' ' ' LEU . 12.0 m-85 -107.23 116.7 32.4 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 108.472 -0.936 . . . . 74.14 108.472 179.067 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.452 ' HG1' ' HG2' ' A' ' 43' ' ' GLU . 29.8 m -88.77 99.33 12.28 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 107.589 -1.263 . . . . 73.21 107.589 177.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.553 HG11 HG12 ' A' ' 71' ' ' ILE . 47.0 t -91.84 103.64 14.75 Favored 'Isoleucine or valine' 0 C--O 1.239 0.545 0 N-CA-C 107.339 -1.356 . . . . 73.12 107.339 -178.201 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.576 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 43.1 mt-10 -85.44 101.66 12.8 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.136 -1.393 . . . . 73.52 108.759 -174.708 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.492 ' HB ' HG11 ' A' ' 11' ' ' VAL . 34.5 t -112.09 112.75 41.86 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 C-N-CA 123.985 0.914 . . . . 72.31 108.944 -175.026 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.634 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 42.1 tt0 -105.04 149.39 25.84 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.586 0.755 . . . . 74.5 111.164 -174.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -77.11 112.02 13.31 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.687 0.795 . . . . 74.23 109.188 173.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -121.21 111.69 17.71 Favored 'General case' 0 C--O 1.242 0.694 0 N-CA-C 107.891 -1.152 . . . . 73.52 107.891 171.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 75.09 -109.35 2.76 Favored Glycine 0 C--N 1.346 1.121 0 N-CA-C 110.778 -0.929 . . . . 55.11 110.778 -174.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -123.13 5.61 9.22 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.328 0.651 . . . . 62.22 109.822 176.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 67.9 p -110.54 148.0 33.02 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.382 0.673 . . . . 74.44 110.912 -176.16 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -96.17 112.02 23.89 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.185 0.994 . . . . 74.33 108.826 173.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.0 t -113.79 131.31 56.27 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 123.666 0.786 . . . . 73.3 110.211 -173.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.406 HG23 HG21 ' A' ' 59' ' ' VAL . 98.4 t -70.28 107.71 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 N-CA-C 109.247 -0.649 . . . . 73.4 109.247 174.264 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.634 ' HD3' ' HB3' ' A' ' 60' ' ' GLU . 30.6 mmmt -66.82 -52.83 39.19 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 115.23 -0.895 . . . . 74.31 109.498 176.288 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.5 ptt180 -162.71 164.9 26.2 Favored 'General case' 0 C--O 1.241 0.636 0 CA-C-N 114.508 -1.224 . . . . 71.3 109.779 -179.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.553 HG12 HG11 ' A' ' 57' ' ' VAL . 41.5 mt -121.93 107.69 20.44 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 C-N-CA 123.947 0.899 . . . . 60.32 108.606 175.527 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 36.4 m -93.22 103.82 16.05 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.6 0.76 . . . . 72.44 109.836 -176.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 36.9 ttt180 -79.43 133.89 36.55 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.012 0.525 . . . . 74.14 109.63 175.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 8.1 t . . . . . 0 CA--C 1.544 0.735 0 N-CA-C 109.45 -0.574 . . . . 74.23 109.45 170.333 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 . . . . . 0 CA--C 1.54 0.576 0 N-CA-C 110.376 -0.231 . . . . 74.44 110.376 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.512 ' O ' HG22 ' A' ' 11' ' ' VAL . 33.5 mm-40 -63.15 -49.76 73.05 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-O 118.988 -0.53 . . . . 75.01 110.02 177.333 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.46 -25.82 68.19 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 112.153 0.427 . . . . 75.12 112.153 178.646 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -63.65 -45.46 90.09 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.067 0.46 . . . . 75.34 109.832 172.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -69.04 -37.73 78.74 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 115.229 -0.896 . . . . 72.23 110.843 177.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.523 HG21 HD12 ' A' ' 40' ' ' ILE . 79.7 t -66.23 -50.68 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 123.806 0.842 . . . . 74.2 111.769 -174.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.494 ' HD3' HG23 ' A' ' 33' ' ' VAL . 34.3 mtmm -65.84 -32.86 74.62 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 123.236 0.335 . . . . 71.43 111.036 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.401 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 8.8 tt0 -65.89 -53.52 38.51 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 123.728 0.642 . . . . 74.2 110.285 177.082 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.47 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 78.9 t -59.2 -37.72 70.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 C-N-CA 123.03 0.532 . . . . 75.43 110.351 178.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.36 -44.77 86.59 Favored 'General case' 0 C--O 1.246 0.901 0 C-N-CA 123.613 0.765 . . . . 73.51 111.899 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -71.38 -31.24 67.08 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 116.396 -0.365 . . . . 73.53 110.591 -178.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.487 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 47.1 mt-10 -65.79 -39.86 91.36 Favored 'General case' 0 C--N 1.355 0.816 0 O-C-N 123.899 0.749 . . . . 74.03 110.686 179.766 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.47 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 67.8 mmtt -73.21 -28.2 62.04 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-O 120.81 0.338 . . . . 72.23 110.69 178.718 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.562 ' HB3' HD12 ' A' ' 46' ' ' LEU . 53.3 mt -70.2 -31.09 68.37 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.971 0.509 . . . . 75.2 111.069 169.472 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.1 mt -79.68 -17.95 52.49 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.891 0.876 . . . . 74.13 110.946 175.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 8.7 mm-40 -71.63 -41.05 69.29 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 109.736 -0.468 . . . . 74.0 109.736 172.278 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.417 ' NE2' HD22 ' A' ' 19' ' ' LEU . 42.0 mt-30 -76.54 -37.25 56.94 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 115.276 -0.875 . . . . 64.41 110.554 178.293 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.3 t -153.69 86.42 3.9 Favored Pre-proline 0 CA--C 1.551 1.006 0 C-N-CA 123.693 0.797 . . . . 62.04 110.779 -173.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo -78.37 -19.22 11.91 Favored 'Trans proline' 0 C--N 1.374 1.92 0 C-N-CA 122.505 2.137 . . . . 71.53 112.629 177.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.452 ' N ' HD21 ' A' ' 25' ' ' ASN . 0.7 OUTLIER -77.44 -19.68 55.67 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.68 0.792 . . . . 73.31 111.05 -175.24 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 31.4 m -100.13 141.58 32.76 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.178 0.591 . . . . 73.12 110.047 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -77.4 119.85 21.58 Favored 'General case' 0 C--O 1.243 0.755 0 C-N-CA 124.03 0.932 . . . . 72.41 109.546 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.9 t -98.32 112.4 30.33 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 N-CA-C 109.429 -0.582 . . . . 72.25 109.429 -178.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.442 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 30.7 mm-40 -94.93 174.42 7.1 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.353 1.061 . . . . 65.01 109.367 172.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 47.1 t -106.38 137.21 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 N-CA-C 108.961 -0.755 . . . . 73.31 108.961 169.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -102.7 -54.2 2.7 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.936 0.495 . . . . 74.25 110.19 179.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -153.88 147.84 25.55 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.994 0.918 . . . . 72.22 109.103 -176.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.518 HG11 HG22 ' A' ' 42' ' ' VAL . 88.1 t -121.51 118.83 57.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 N-CA-C 108.347 -0.983 . . . . 73.22 108.347 176.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -116.66 109.87 17.75 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.146 0.578 . . . . 73.04 109.743 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.526 ' HG2' HG12 ' A' ' 40' ' ' ILE . 2.8 tmtp? -83.65 117.25 23.06 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 107.138 -1.43 . . . . 75.12 107.138 178.664 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.0 89.88 2.81 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 108.983 -0.747 . . . . 71.41 108.983 -178.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.08 -111.46 3.94 Favored Glycine 0 C--N 1.344 1.023 0 O-C-N 123.612 0.57 . . . . 74.12 113.464 173.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -96.92 1.14 50.09 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.29 0.636 . . . . 73.42 111.388 177.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 23.7 m -131.24 107.88 9.3 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.327 0.651 . . . . 75.55 110.211 -176.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.526 HG12 ' HG2' ' A' ' 35' ' ' LYS . 33.7 mt -83.62 107.46 15.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 N-CA-C 108.497 -0.927 . . . . 71.45 108.497 172.089 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.524 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 98.1 mtt180 -86.36 95.27 9.6 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 109.008 -0.738 . . . . 75.11 109.008 176.097 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.518 HG22 HG11 ' A' ' 33' ' ' VAL . 58.5 t -86.73 113.48 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 N-CA-C 108.762 -0.829 . . . . 71.34 108.762 177.194 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.531 ' HG2' ' HG1' ' A' ' 56' ' ' THR . 35.3 mt-10 -86.98 104.42 16.28 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 124.087 0.955 . . . . 64.31 108.518 174.523 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.442 ' HB3' ' O ' ' A' ' 29' ' ' GLN . 4.8 mp -97.24 165.93 11.81 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 109.754 -0.461 . . . . 73.05 109.754 179.393 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -116.64 104.85 11.8 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.119 0.485 . . . . 72.42 109.983 -179.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.562 HD12 ' HB3' ' A' ' 19' ' ' LEU . 6.8 tt -107.42 129.39 54.94 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 106.927 -1.508 . . . . 73.4 106.927 177.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 55.8 mtm180 . . . . . 0 N--CA 1.471 0.614 0 N-CA-C 108.48 -0.933 . . . . 71.12 108.48 -178.302 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt . . . . . 0 CA--C 1.536 0.44 0 N-CA-C 108.562 -0.903 . . . . 75.53 108.562 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -126.26 145.38 50.43 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.17 0.588 . . . . 75.13 110.17 -177.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -108.32 129.98 55.21 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.207 0.603 . . . . 75.31 109.421 177.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.464 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 42.0 m-85 -113.91 118.93 35.58 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 108.911 -0.774 . . . . 73.14 108.911 179.085 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.531 ' HG1' ' HG2' ' A' ' 43' ' ' GLU . 31.9 m -83.57 101.45 11.47 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 108.948 -0.76 . . . . 74.44 108.948 176.192 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.445 HG12 HG12 ' A' ' 71' ' ' ILE . 48.0 t -94.91 110.38 23.81 Favored 'Isoleucine or valine' 0 C--O 1.239 0.514 0 CA-C-N 115.24 -0.891 . . . . 72.5 109.274 179.362 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.524 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 37.3 mt-10 -78.66 106.35 10.58 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.961 0.904 . . . . 70.1 109.089 177.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.542 HG23 HG22 ' A' ' 68' ' ' VAL . 41.6 t -111.65 114.36 46.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 N-CA-C 108.657 -0.868 . . . . 73.42 108.657 178.009 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -102.26 155.88 17.93 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.279 1.032 . . . . 64.0 110.781 -171.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.446 ' NH2' ' HA ' ' A' ' 64' ' ' ASN . 14.6 tpt180 -89.35 133.09 34.65 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.637 0.775 . . . . 75.15 110.146 -177.216 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -141.22 91.85 2.43 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 108.729 -0.841 . . . . 74.41 108.729 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.94 -102.78 1.03 Allowed Glycine 0 C--N 1.345 1.031 0 CA-C-N 116.095 -0.502 . . . . 44.52 112.707 179.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.446 ' HA ' ' NH2' ' A' ' 61' ' ' ARG . 19.8 m-80 -115.15 1.94 13.99 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.158 0.983 . . . . 73.14 111.174 177.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 71.5 p -115.51 166.63 11.68 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.812 0.845 . . . . 74.24 110.769 -178.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -117.65 136.37 53.37 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.116 0.966 . . . . 73.45 108.77 174.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 6.2 t -126.01 122.38 35.72 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.004 0.921 . . . . 72.42 110.048 -175.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.542 HG22 HG23 ' A' ' 59' ' ' VAL . 86.2 t -73.59 115.83 15.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 122.593 0.357 . . . . 72.12 110.203 178.23 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -74.57 -57.07 4.16 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.028 0.931 . . . . 73.44 110.441 178.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -160.47 148.2 16.2 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 116.174 -0.466 . . . . 75.03 110.683 -178.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.469 HD13 ' HB2' ' A' ' 18' ' ' LYS . 47.0 mt -105.44 106.78 21.16 Favored 'Isoleucine or valine' 0 C--O 1.24 0.596 0 N-CA-C 108.608 -0.886 . . . . 74.14 108.608 168.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 66.7 m -109.57 115.59 30.18 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.683 0.793 . . . . 72.24 108.92 176.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.464 ' HA ' ' HA ' ' A' ' 55' ' ' TYR . 49.4 ttp180 -68.38 145.66 53.94 Favored 'General case' 0 C--O 1.243 0.722 0 N-CA-C 109.473 -0.566 . . . . 74.24 109.473 176.283 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 14.6 t . . . . . 0 C--O 1.242 0.69 0 O-C-N 123.863 0.727 . . . . 72.11 110.081 -179.464 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.5 mm-40 . . . . . 0 N--CA 1.478 0.969 0 N-CA-C 112.744 0.646 . . . . 74.02 112.744 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.553 ' O ' HG21 ' A' ' 11' ' ' VAL . 77.2 mt-10 -57.14 -56.89 15.95 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 124.085 0.866 . . . . 74.54 109.407 170.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -69.21 -32.21 71.32 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.257 0.623 . . . . 75.11 110.71 -176.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 29.8 mmt180 -55.45 -48.98 73.63 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.564 0.746 . . . . 62.2 110.122 174.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.537 ' O ' HG21 ' A' ' 14' ' ' VAL . 64.7 mt-30 -64.32 -45.38 88.15 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 114.26 -1.336 . . . . 70.31 111.16 178.172 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.594 HG23 HD12 ' A' ' 40' ' ' ILE . 59.0 t -61.53 -44.51 98.72 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 123.23 0.612 . . . . 73.33 111.899 -176.044 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt -65.19 -34.25 77.94 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.092 0.557 . . . . 75.42 110.24 178.27 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.479 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 8.5 tt0 -64.59 -51.7 61.33 Favored 'General case' 0 C--N 1.352 0.704 0 CA-C-N 115.656 -0.702 . . . . 72.5 110.418 175.192 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.537 HG21 ' O ' ' A' ' 10' ' ' GLN . 45.0 t -56.5 -46.75 82.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 C-N-CA 123.129 0.572 . . . . 74.12 109.578 -179.307 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.407 ' HB1' HD11 ' A' ' 44' ' ' LEU . . . -60.23 -47.5 85.72 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 114.896 -1.047 . . . . 62.41 112.29 -179.305 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -71.1 -35.4 71.8 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 122.822 0.449 . . . . 74.45 111.321 -175.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 36.4 mm-40 -69.09 -34.6 75.35 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.933 0.493 . . . . 75.51 111.021 -179.678 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.58 ' HB3' HD12 ' A' ' 71' ' ' ILE . 75.2 mmtt -68.16 -35.43 78.06 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.955 0.502 . . . . 70.31 111.063 176.102 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.547 ' HB3' HD12 ' A' ' 46' ' ' LEU . 29.8 mt -68.05 -31.84 71.78 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 115.518 -0.764 . . . . 74.33 111.291 174.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 84.9 mt -73.75 -26.11 60.5 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.927 0.891 . . . . 74.14 111.268 174.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 62.9 mm-40 -66.94 -40.68 87.63 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.652 0.381 . . . . 73.1 110.288 173.309 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -72.89 -40.92 65.19 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 123.892 0.745 . . . . 74.13 111.087 178.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.2 t -142.68 99.79 5.64 Favored Pre-proline 0 CA--C 1.548 0.867 0 CA-C-N 115.358 -0.837 . . . . 71.13 109.349 -175.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -79.61 -3.5 12.95 Favored 'Trans proline' 0 C--N 1.38 2.219 0 C-N-CA 122.598 2.198 . . . . 75.11 111.995 171.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -101.07 21.63 13.55 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.015 1.326 . . . . 75.34 110.269 -179.29 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 92.9 p -125.89 153.46 44.16 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 112.321 0.489 . . . . 72.12 112.321 -175.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -96.76 121.98 39.21 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 108.327 -0.99 . . . . 54.11 108.327 164.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 38.7 t -100.95 113.21 36.27 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 122.919 0.488 . . . . 73.12 109.739 177.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -96.74 159.4 14.95 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.225 1.01 . . . . 71.31 108.752 170.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.6 p -98.85 118.3 45.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 N-CA-C 108.413 -0.958 . . . . 72.04 108.413 170.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 21.8 tpt180 -85.78 -57.65 2.96 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 123.035 0.534 . . . . 75.21 110.429 -174.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.0 tpt180 -156.61 144.14 19.14 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.511 0.724 . . . . 75.31 109.753 -172.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 86.0 t -127.95 122.75 59.23 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 123.139 0.576 . . . . 72.32 110.282 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -106.8 129.53 54.65 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.641 1.176 . . . . 74.52 108.863 169.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.474 ' HG2' HG12 ' A' ' 40' ' ' ILE . 13.1 tmtt? -104.88 108.08 19.38 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 106.989 -1.486 . . . . 75.24 106.989 173.191 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -122.66 93.29 3.92 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.273 0.629 . . . . 73.41 110.173 -177.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 70.08 -98.13 0.62 Allowed Glycine 0 C--N 1.35 1.346 0 CA-C-N 115.497 -0.774 . . . . 73.22 112.343 178.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 47.5 m-80 -111.08 -29.25 7.96 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.052 0.541 . . . . 72.32 110.21 173.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 19.0 m -83.97 101.47 11.74 Favored 'General case' 0 C--N 1.352 0.69 0 CA-C-O 121.112 0.482 . . . . 74.4 110.204 -178.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.594 HD12 HG23 ' A' ' 11' ' ' VAL . 31.1 mt -87.95 112.69 23.95 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 CA-C-N 115.838 -0.619 . . . . 74.43 109.533 172.538 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.501 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 90.2 mtt180 -81.84 97.77 8.18 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 123.725 0.81 . . . . 75.42 109.645 174.346 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.44 HG11 ' HG ' ' A' ' 44' ' ' LEU . 61.2 t -91.3 107.42 18.69 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 N-CA-C 107.88 -1.156 . . . . 72.01 107.88 172.137 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -82.85 122.16 27.87 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 114.984 -1.007 . . . . 74.44 108.392 168.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.44 ' HG ' HG11 ' A' ' 42' ' ' VAL . 2.5 mp -116.41 153.64 31.7 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 109.358 -0.608 . . . . 74.31 109.358 -179.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.42 ' HG3' ' HD3' ' A' ' 52' ' ' LYS . 31.2 tt0 -111.42 103.89 12.29 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 109.301 -0.629 . . . . 74.12 109.301 175.594 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.547 HD12 ' HB3' ' A' ' 19' ' ' LEU . 7.3 tt -102.38 154.0 19.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.419 1.088 . . . . 74.34 109.444 -174.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 62.9 mtp180 . . . . . 0 N--CA 1.48 1.038 0 C-N-CA 123.439 0.696 . . . . 73.44 110.64 177.493 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.616 ' HZ1' ' HB3' ' A' ' 52' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.415 0 N-CA-C 108.814 -0.81 . . . . 74.24 108.814 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -128.1 111.94 14.04 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.565 1.146 . . . . 65.34 109.061 178.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -78.78 133.68 37.07 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 109.067 -0.716 . . . . 75.52 109.067 173.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -114.41 171.72 7.45 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.431 0.692 . . . . 75.13 109.887 172.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 86.2 m -143.88 102.64 3.93 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 106.7 -1.593 . . . . 74.01 106.7 175.236 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.465 HG21 HG12 ' A' ' 71' ' ' ILE . 46.9 t -98.84 105.06 16.8 Favored 'Isoleucine or valine' 0 C--O 1.243 0.723 0 N-CA-C 107.608 -1.256 . . . . 74.32 107.608 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.501 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 28.1 mt-10 -80.52 102.3 9.65 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 115.442 -0.799 . . . . 74.2 109.433 178.562 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.542 ' HB ' HG13 ' A' ' 11' ' ' VAL . 25.9 t -105.71 115.67 47.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 C-N-CA 124.109 0.963 . . . . 72.41 108.711 -178.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.577 ' HB3' ' HE2' ' A' ' 69' ' ' LYS . 35.6 tt0 -102.25 154.76 18.73 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.72 0.808 . . . . 64.51 110.023 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 29.5 ttp180 -80.29 139.64 36.55 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 120.958 0.408 . . . . 75.54 111.733 177.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -127.09 103.18 7.3 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.89 1.276 . . . . 75.41 107.642 172.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.31 -110.76 3.52 Favored Glycine 0 CA--C 1.53 1.007 0 N-CA-C 111.533 -0.627 . . . . 71.14 111.533 -173.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -101.34 -21.62 14.8 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.01 0.524 . . . . 72.22 110.869 170.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.8 p -86.22 174.73 8.91 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.193 0.597 . . . . 72.53 110.53 -172.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 89.3 m95 -124.98 147.38 48.95 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.625 0.77 . . . . 73.52 108.936 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.2 t -145.91 135.35 23.07 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.078 0.551 . . . . 73.42 110.224 -170.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.576 HG23 ' HG3' ' A' ' 18' ' ' LYS . 70.5 t -85.08 129.76 37.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 123.62 0.768 . . . . 75.13 110.593 -176.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.577 ' HE2' ' HB3' ' A' ' 60' ' ' GLU . 74.8 mmtt -81.5 -50.39 9.46 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.916 -0.583 . . . . 62.21 109.871 175.229 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 26.9 ptt-85 -168.83 167.63 10.92 Favored 'General case' 0 C--O 1.245 0.84 0 CA-C-N 115.35 -0.841 . . . . 74.01 110.111 -177.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.58 HD12 ' HB3' ' A' ' 18' ' ' LYS . 59.5 mt -117.81 109.09 26.26 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 115.089 -0.96 . . . . 74.33 108.851 173.568 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 34.2 m -102.56 124.3 47.86 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 109.677 -0.49 . . . . 71.0 109.677 178.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 46.7 ttp180 -82.82 146.85 28.7 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 108.718 -0.845 . . . . 74.32 108.718 171.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.3 t . . . . . 0 C--O 1.247 0.929 0 C-N-CA 123.034 0.534 . . . . 73.23 110.368 172.976 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.407 ' O ' ' HG2' ' A' ' 10' ' ' GLN . 2.6 mp0 . . . . . 0 C--O 1.242 0.685 0 N-CA-C 111.528 0.196 . . . . 74.41 111.528 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.501 ' O ' HG21 ' A' ' 11' ' ' VAL . 51.0 mt-10 -56.43 -55.38 34.28 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 109.018 -0.734 . . . . 75.22 109.018 171.076 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.464 ' HG3' HG12 ' A' ' 33' ' ' VAL . 0.6 OUTLIER -55.91 -40.96 73.83 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 124.918 1.386 . . . . 74.32 110.368 -175.27 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 84.1 mtt-85 -55.25 -46.0 76.05 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.233 1.013 . . . . 75.03 110.66 177.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.428 ' O ' HG22 ' A' ' 14' ' ' VAL . 68.3 mm-40 -72.29 -50.89 23.61 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.423 -0.808 . . . . 75.23 110.739 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.501 HG21 ' O ' ' A' ' 7' ' ' GLU . 43.0 t -64.32 -35.98 75.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 124.156 0.982 . . . . 72.14 112.026 -167.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 47.2 mtmt -63.1 -41.83 99.45 Favored 'General case' 0 N--CA 1.484 1.237 0 O-C-N 123.277 0.361 . . . . 74.04 110.09 176.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.461 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 9.5 tt0 -67.3 -43.94 80.46 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 124.249 0.968 . . . . 72.34 110.315 178.554 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.477 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 98.9 t -60.58 -43.43 94.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.369 0.668 . . . . 75.14 109.682 178.297 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.06 -41.61 73.92 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 114.782 -1.099 . . . . 52.11 112.078 -174.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -67.13 -36.86 82.78 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 123.484 0.49 . . . . 74.23 110.114 -177.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.463 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 50.8 mt-10 -58.48 -46.01 87.52 Favored 'General case' 0 C--N 1.366 1.285 0 O-C-N 124.306 1.004 . . . . 74.42 109.788 177.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.477 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 31.9 mmmt -56.3 -43.76 79.24 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 124.671 1.232 . . . . 75.43 111.014 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 43.6 mt -72.08 -29.74 64.41 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 114.948 -1.023 . . . . 72.52 111.5 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.7 mt -76.03 -25.23 55.45 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.293 0.637 . . . . 73.44 111.108 176.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 17.4 mm-40 -67.42 -35.02 78.44 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-O 121.453 0.644 . . . . 74.31 109.911 175.276 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.422 HE22 HG21 ' A' ' 71' ' ' ILE . 48.0 mt-30 -88.77 -28.6 20.38 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 114.931 -1.031 . . . . 74.24 111.336 -179.152 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.487 ' HB3' HD11 ' A' ' 46' ' ' LEU . 32.4 t -150.93 84.92 5.26 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 123.248 0.619 . . . . 73.51 110.332 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -79.73 -6.41 14.33 Favored 'Trans proline' 0 C--N 1.376 2.019 0 C-N-CA 122.78 2.32 . . . . 75.43 112.946 176.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -90.11 7.49 37.62 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.655 0.782 . . . . 72.11 111.754 -178.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 39.9 t -133.25 158.52 42.7 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.375 0.67 . . . . 74.25 109.787 176.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -99.81 131.64 45.67 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.734 0.813 . . . . 74.2 108.948 177.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 40.9 t -98.46 129.92 48.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 C-N-CA 123.669 0.787 . . . . 74.34 109.679 -178.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -108.95 163.43 13.3 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.842 1.257 . . . . 73.31 109.526 177.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.8 p -90.99 119.06 37.45 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 N-CA-C 108.936 -0.765 . . . . 74.45 108.936 172.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 32.1 tpt180 -91.08 -58.37 2.49 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 109.195 -0.669 . . . . 62.11 109.195 178.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 -150.84 163.87 37.61 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.695 1.198 . . . . 75.43 109.578 173.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.513 HG13 HG22 ' A' ' 42' ' ' VAL . 47.0 t -131.96 115.85 28.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 N-CA-C 108.235 -1.024 . . . . 64.32 108.235 172.859 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 24.3 mp0 -101.23 124.98 47.77 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.363 0.665 . . . . 61.41 110.309 177.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.4 tptt -95.79 111.49 23.44 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.543 1.137 . . . . 73.2 109.341 175.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.26 72.2 0.98 Allowed 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 108.892 -0.781 . . . . 75.53 108.892 175.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 59.33 -104.35 0.53 Allowed Glycine 0 C--N 1.344 0.996 0 CA-C-N 115.353 -0.84 . . . . 55.21 113.121 179.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -75.55 -41.56 54.62 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.082 0.553 . . . . 75.25 110.503 -179.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.465 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 29.0 m -95.57 117.94 31.36 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.214 0.605 . . . . 72.4 111.144 -175.217 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 38.2 mt -98.04 116.8 41.64 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 123.558 0.743 . . . . 73.21 109.235 169.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 61.5 mtt180 -103.37 99.66 9.5 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 108.594 -0.891 . . . . 64.51 108.594 178.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.513 HG22 HG13 ' A' ' 33' ' ' VAL . 39.5 t -85.52 125.87 40.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 109.098 -0.704 . . . . 70.14 109.098 179.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -85.93 122.03 29.4 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 107.953 -1.129 . . . . 72.31 107.953 166.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.426 ' O ' ' HA ' ' A' ' 54' ' ' ASN . 4.2 mp -117.53 169.06 9.84 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.073 0.549 . . . . 60.21 109.643 178.052 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -134.19 103.0 5.58 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.224 0.535 . . . . 72.11 109.612 -174.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.487 HD11 ' HB3' ' A' ' 23' ' ' SER . 8.7 tt -110.36 134.79 51.95 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 106.831 -1.544 . . . . 72.44 106.831 178.308 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 74.7 mtt85 . . . . . 0 N--CA 1.471 0.587 0 CA-C-O 121.463 0.649 . . . . 74.41 110.1 -175.595 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 79.4 tttt . . . . . 0 CA--C 1.543 0.698 0 N-CA-C 109.664 -0.495 . . . . 61.21 109.664 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -105.66 112.87 26.11 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.887 0.875 . . . . 73.35 109.457 175.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.426 ' HA ' ' O ' ' A' ' 44' ' ' LEU . 17.0 m120 -91.65 118.4 30.61 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.128 0.571 . . . . 72.13 110.239 176.68 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -108.14 120.69 43.07 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 109.043 -0.725 . . . . 73.04 109.043 177.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 57.0 m -88.31 102.41 14.82 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.841 -0.8 . . . . 74.5 108.841 173.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 96.7 t -93.22 106.09 17.56 Favored 'Isoleucine or valine' 0 C--O 1.24 0.564 0 N-CA-C 108.371 -0.974 . . . . 72.24 108.371 179.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -86.17 104.28 15.59 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 114.491 -1.232 . . . . 73.21 108.811 -176.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 17.5 t -113.84 128.88 70.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 124.138 0.975 . . . . 65.55 108.7 -178.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.465 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 38.2 tt0 -112.33 150.02 31.61 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.089 0.555 . . . . 62.41 110.476 -176.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.4 tpp85 -73.08 128.34 35.19 Favored 'General case' 0 C--N 1.35 0.59 0 C-N-CA 123.912 0.885 . . . . 72.24 110.649 -177.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -122.95 90.44 3.29 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 107.911 -1.144 . . . . 71.42 107.911 172.029 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 72.2 -103.32 1.29 Allowed Glycine 0 C--N 1.348 1.225 0 CA-C-N 116.127 -0.488 . . . . 54.25 112.603 -177.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -119.83 2.9 11.1 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 124.125 0.97 . . . . 74.43 110.247 173.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 18.7 p -113.5 176.59 4.96 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.519 0.728 . . . . 74.22 109.705 176.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -118.72 153.36 34.52 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.051 0.941 . . . . 74.01 111.323 -174.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 4.9 t -137.33 117.41 13.41 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.217 1.007 . . . . 74.35 108.741 175.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.7 t -69.41 108.46 1.88 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.508 0 N-CA-C 109.254 -0.647 . . . . 74.45 109.254 176.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -67.49 -57.53 6.36 Favored 'General case' 0 C--O 1.237 0.432 0 O-C-N 123.983 0.802 . . . . 63.14 110.27 177.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -151.36 141.03 21.76 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.117 -0.492 . . . . 74.2 111.329 -172.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.422 HG21 HE22 ' A' ' 22' ' ' GLN . 34.1 mm -93.46 105.43 16.82 Favored 'Isoleucine or valine' 0 C--N 1.352 0.692 0 N-CA-C 107.884 -1.154 . . . . 75.3 107.884 165.079 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 74.4 m -96.49 131.17 43.36 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 108.724 -0.843 . . . . 75.11 108.724 173.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -98.31 148.51 23.58 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 108.731 -0.84 . . . . 73.25 108.731 172.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.4 t . . . . . 0 CA--C 1.551 1.017 0 N-CA-C 109.153 -0.684 . . . . 72.02 109.153 170.12 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.475 ' HA ' ' HD3' ' A' ' 9' ' ' ARG . 37.1 tt0 . . . . . 0 N--CA 1.479 1.002 0 N-CA-C 111.759 0.281 . . . . 73.3 111.759 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.595 ' HG3' ' HD2' ' A' ' 8' ' ' LYS . 9.7 pt-20 -60.27 -33.95 73.04 Favored 'General case' 0 C--O 1.211 -0.958 0 CA-C-O 119.451 -0.309 . . . . 71.22 110.48 178.512 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.595 ' HD2' ' HG3' ' A' ' 7' ' ' GLU . 12.3 mptt -64.45 -43.86 92.96 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.16 0.584 . . . . 73.41 110.067 175.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.475 ' HD3' ' HA ' ' A' ' 6' ' ' GLU . 72.2 mtp180 -57.92 -43.26 86.12 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.117 0.967 . . . . 73.4 110.392 177.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.422 ' O ' HG22 ' A' ' 14' ' ' VAL . 50.8 mt-30 -64.71 -46.41 82.45 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 114.537 -1.211 . . . . 73.2 110.839 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.581 HG11 ' HB ' ' A' ' 59' ' ' VAL . 41.4 t -63.07 -39.7 86.21 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 124.793 1.237 . . . . 72.14 111.927 -177.148 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.474 ' HE2' ' HA ' ' A' ' 9' ' ' ARG . 49.8 mtmt -64.06 -37.5 87.67 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.54 0.736 . . . . 64.2 110.397 178.491 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -71.41 -43.67 66.35 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-N 115.552 -0.749 . . . . 75.34 110.554 179.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.422 HG22 ' O ' ' A' ' 10' ' ' GLN . 87.7 t -58.94 -42.3 85.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 124.036 0.934 . . . . 64.41 110.299 176.41 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.34 -48.93 68.66 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 114.825 -1.079 . . . . 75.1 111.777 -177.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.412 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 19.8 ptmt -67.09 -28.55 68.27 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 115.755 -0.657 . . . . 64.44 111.051 -175.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -60.56 -43.83 96.84 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.429 0.691 . . . . 75.32 111.478 176.031 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.485 ' HG3' HG23 ' A' ' 68' ' ' VAL . 59.3 mmtt -70.54 -26.7 63.69 Favored 'General case' 0 N--CA 1.481 1.108 0 O-C-N 123.708 0.63 . . . . 74.12 110.147 -178.579 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.692 ' HB3' HD11 ' A' ' 46' ' ' LEU . 21.8 mt -75.23 -32.06 61.04 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 115.107 -0.951 . . . . 75.44 111.22 173.481 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 95.4 mt -73.35 -21.79 60.45 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.425 0.69 . . . . 75.2 111.287 175.638 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -66.67 -36.18 81.92 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-O 121.544 0.687 . . . . 75.45 110.09 173.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.426 HE21 ' HA ' ' A' ' 19' ' ' LEU . 45.8 mt-30 -81.29 -41.51 22.02 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 114.82 -1.082 . . . . 72.41 111.069 -179.723 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.4 t -153.96 89.45 3.41 Favored Pre-proline 0 CA--C 1.554 1.114 0 C-N-CA 123.524 0.73 . . . . 73.32 109.364 -174.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.33 -26.73 10.13 Favored 'Trans proline' 0 C--N 1.375 1.943 0 C-N-CA 122.809 2.339 . . . . 73.53 113.067 177.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -68.9 -25.98 64.87 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.633 0.773 . . . . 74.12 111.298 -174.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 35.0 p -84.11 138.36 33.07 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.781 0.832 . . . . 63.5 110.845 177.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.504 ' HB3' ' NH2' ' A' ' 47' ' ' ARG . 2.7 tpmt? -82.31 111.78 18.69 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 108.432 -0.951 . . . . 64.41 108.432 175.165 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 41.0 t -97.45 120.05 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 124.062 0.945 . . . . 72.45 109.512 -173.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.437 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 84.5 mm-40 -107.27 172.18 6.97 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.261 1.024 . . . . 64.15 109.219 174.173 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.448 HG23 ' HB3' ' A' ' 12' ' ' LYS . 57.6 t -102.55 123.05 55.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 108.627 -0.879 . . . . 73.34 108.627 176.056 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.5 tpt180 -92.13 -48.13 6.88 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.152 0.581 . . . . 74.45 110.684 -174.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -149.26 145.04 26.88 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.572 1.149 . . . . 73.13 107.932 -173.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.428 HG23 HG11 ' A' ' 42' ' ' VAL . 86.3 t -125.17 130.6 73.03 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 N-CA-C 108.519 -0.919 . . . . 72.43 108.519 173.161 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -120.43 108.28 13.92 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.15 0.98 . . . . 63.33 109.415 178.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.6 tmtt? -97.16 111.97 23.97 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 108.312 -0.995 . . . . 74.13 108.312 -177.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -126.0 86.69 2.56 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.46 0.704 . . . . 72.33 109.48 -176.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 60.56 -80.77 0.01 OUTLIER Glycine 0 C--N 1.353 1.489 0 N-CA-C 115.223 0.849 . . . . 70.23 115.223 172.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -103.68 -45.81 4.7 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.181 0.993 . . . . 72.13 110.359 -177.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.557 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 8.9 m -100.33 133.69 44.37 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.231 0.613 . . . . 62.2 111.134 -175.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.571 HD12 HG22 ' A' ' 11' ' ' VAL . 32.7 mt -110.5 109.01 26.88 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.9 0 C-N-CA 123.481 0.712 . . . . 75.01 109.395 174.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 39.3 mtm180 -86.19 96.77 10.03 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 109.24 -0.652 . . . . 72.34 109.24 176.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.449 HG22 HG12 ' A' ' 11' ' ' VAL . 60.7 t -90.82 117.01 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 123.143 0.577 . . . . 75.42 109.47 176.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.554 ' HG2' ' HG1' ' A' ' 56' ' ' THR . 46.5 mt-10 -91.73 115.28 27.92 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.462 1.105 . . . . 70.33 108.83 174.598 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.437 ' HB3' ' O ' ' A' ' 29' ' ' GLN . 4.1 mp -111.1 159.48 17.78 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 122.025 -0.422 . . . . 64.25 110.375 -176.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -106.48 107.19 18.07 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 109.184 -0.673 . . . . 72.32 109.184 178.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.692 HD11 ' HB3' ' A' ' 19' ' ' LEU . 7.1 tt -111.19 125.47 53.83 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 106.918 -1.512 . . . . 74.24 106.918 175.547 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.504 ' NH2' ' HB3' ' A' ' 27' ' ' LYS . 43.4 mtm180 . . . . . 0 N--CA 1.473 0.685 0 N-CA-C 109.282 -0.636 . . . . 70.23 109.282 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 76.4 tttt . . . . . 0 N--CA 1.48 1.047 0 CA-C-O 120.821 0.343 . . . . 75.23 110.448 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -134.53 122.31 22.23 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.911 1.284 . . . . 64.35 108.276 175.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -88.03 140.2 29.74 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 109.787 -0.449 . . . . 70.44 109.787 176.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -120.46 121.58 38.8 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.333 0.653 . . . . 73.32 109.562 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.554 ' HG1' ' HG2' ' A' ' 43' ' ' GLU . 24.6 m -86.97 103.72 15.61 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 108.17 -1.048 . . . . 73.1 108.17 175.786 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.402 HG12 HD11 ' A' ' 71' ' ' ILE . 58.7 t -102.3 114.81 42.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 124.218 1.007 . . . . 63.43 109.096 -179.181 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -89.02 101.98 14.63 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 109.063 -0.717 . . . . 73.0 109.063 179.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.581 ' HB ' HG11 ' A' ' 11' ' ' VAL . 22.2 t -105.11 109.99 29.48 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 C-N-CA 123.551 0.74 . . . . 64.33 109.273 178.055 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.557 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 34.8 tt0 -102.07 144.62 30.43 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.765 1.226 . . . . 73.24 111.039 -172.043 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 7.5 tpp180 -69.73 105.81 2.87 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.643 0.777 . . . . 73.11 109.574 176.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 52.2 tp60 -97.17 86.42 3.94 Favored 'General case' 0 C--O 1.242 0.707 0 N-CA-C 108.58 -0.896 . . . . 72.3 108.58 176.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 68.71 -101.02 0.73 Allowed Glycine 0 C--N 1.348 1.2 0 CA-C-N 115.18 -0.918 . . . . 54.13 111.168 -175.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -100.37 -33.05 10.54 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.67 1.188 . . . . 60.42 110.25 176.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 24.8 p -86.32 177.38 7.49 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.878 0.871 . . . . 64.52 110.814 -178.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -111.78 158.94 18.77 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.059 0.944 . . . . 73.41 109.038 172.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.5 t -145.99 137.65 24.98 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.675 0.79 . . . . 73.42 109.13 179.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.485 HG23 ' HG3' ' A' ' 18' ' ' LYS . 96.7 t -86.03 115.12 26.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 N-CA-C 108.94 -0.763 . . . . 74.3 108.94 176.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -74.89 -49.74 19.32 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 124.297 1.039 . . . . 61.33 110.25 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.1 ptp85 -157.89 159.92 37.1 Favored 'General case' 0 C--O 1.244 0.792 0 CA-C-N 115.228 -0.896 . . . . 73.03 111.277 177.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.402 HD11 HG12 ' A' ' 57' ' ' VAL . 36.4 mm -114.41 122.98 69.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 N-CA-C 106.508 -1.664 . . . . 75.11 106.508 167.281 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 11.7 t -126.98 133.93 50.48 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 109.116 -0.698 . . . . 75.2 109.116 171.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 22.1 ttm180 -91.92 140.33 29.78 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.382 -0.97 . . . . 75.52 108.382 176.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.3 t . . . . . 0 C--O 1.243 0.733 0 N-CA-C 108.533 -0.914 . . . . 64.41 108.533 171.777 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 . . . . . 0 N--CA 1.468 0.457 0 N-CA-C 111.428 0.158 . . . . 72.02 111.428 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.513 ' O ' HG22 ' A' ' 11' ' ' VAL . 6.4 mm-40 -58.03 -55.53 33.7 Favored 'General case' 0 C--N 1.347 0.475 0 O-C-N 123.634 0.584 . . . . 73.52 110.13 176.772 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -33.37 75.81 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 123.099 0.25 . . . . 73.25 111.309 179.775 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 20.5 mtp180 -65.16 -33.74 76.72 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 122.871 0.468 . . . . 74.42 110.786 178.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -68.62 -49.63 57.74 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.362 0.665 . . . . 71.42 109.694 171.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.58 HG12 ' HB ' ' A' ' 59' ' ' VAL . 89.9 t -64.16 -46.3 93.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 123.543 0.737 . . . . 71.1 112.562 -171.057 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.455 ' HD3' HG23 ' A' ' 33' ' ' VAL . 50.5 mtmt -64.97 -36.04 83.13 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.364 0.666 . . . . 73.5 110.715 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.557 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 8.8 tt0 -66.43 -55.63 14.83 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.022 -0.99 . . . . 73.12 109.661 177.517 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.498 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 75.5 t -52.9 -43.16 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 123.439 0.695 . . . . 72.23 110.086 177.033 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.87 -45.06 91.05 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-N 115.065 -0.97 . . . . 75.34 111.787 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.401 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 19.6 ptmt -74.48 -28.47 61.03 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.259 -0.428 . . . . 60.51 110.873 -178.776 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.557 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 19.2 mm-40 -65.83 -35.78 81.63 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 123.43 0.456 . . . . 73.24 110.144 176.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.54 ' HG3' HG23 ' A' ' 68' ' ' VAL . 28.6 mmmt -73.37 -31.0 63.67 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 115.564 -0.744 . . . . 72.24 110.934 178.321 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.803 ' HB3' HD11 ' A' ' 46' ' ' LEU . 26.6 mt -74.42 -26.68 60.22 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.589 -0.732 . . . . 74.25 111.136 172.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 88.3 mt -77.85 -18.94 55.72 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.24 0.616 . . . . 64.4 110.576 172.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -69.79 -38.38 76.63 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.966 0.506 . . . . 74.2 110.515 170.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -76.38 -35.44 58.64 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 115.649 -0.705 . . . . 74.23 110.569 176.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 37.9 t -158.48 96.1 1.84 Allowed Pre-proline 0 CA--C 1.552 1.057 0 C-N-CA 123.259 0.624 . . . . 60.22 110.168 -176.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -77.96 -15.57 14.77 Favored 'Trans proline' 0 C--N 1.38 2.203 0 C-N-CA 123.057 2.505 . . . . 74.12 113.262 -177.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -88.84 -20.65 24.37 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.871 0.868 . . . . 63.44 111.422 -174.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 83.6 p -82.36 158.71 23.26 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.381 0.672 . . . . 74.12 112.744 -172.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -81.06 120.79 25.26 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.624 -0.717 . . . . 74.43 109.476 167.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 39.6 t -110.52 113.91 45.58 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 N-CA-C 108.254 -1.017 . . . . 75.23 108.254 172.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 56.1 tp60 -108.99 145.51 35.4 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.223 1.009 . . . . 73.35 108.743 177.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.2 p -71.26 127.78 33.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.951 0 N-CA-C 109.457 -0.572 . . . . 73.03 109.457 172.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.4 tpt180 -95.54 -62.11 1.35 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 122.657 0.383 . . . . 74.44 110.076 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -151.97 161.44 42.63 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.146 0.979 . . . . 72.31 109.733 -177.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.455 HG23 ' HD3' ' A' ' 12' ' ' LYS . 88.7 t -137.86 119.09 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 C-N-CA 123.911 0.885 . . . . 74.2 109.841 -176.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.678 ' HB3' HE21 ' A' ' 36' ' ' GLN . 21.1 mp0 -120.74 112.65 19.11 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.108 0.963 . . . . 71.13 109.611 -178.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.533 ' HG2' HG12 ' A' ' 40' ' ' ILE . 12.6 tmtt? -83.18 105.17 13.94 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 108.112 -1.069 . . . . 71.43 108.112 178.329 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.678 HE21 ' HB3' ' A' ' 34' ' ' GLN . 84.6 mm-40 -117.45 93.32 4.12 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.725 0.81 . . . . 71.51 110.167 -173.166 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 74.53 -95.68 0.89 Allowed Glycine 0 C--N 1.346 1.102 0 CA-C-N 116.193 -0.458 . . . . 54.53 112.432 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -118.68 -17.82 9.15 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.584 0.753 . . . . 73.03 109.583 172.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.466 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 11.9 m -93.38 106.03 18.04 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.192 0.997 . . . . 74.01 110.353 -177.348 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.551 HD12 HG21 ' A' ' 11' ' ' VAL . 52.7 mt -80.98 108.29 14.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 N-CA-C 108.968 -0.753 . . . . 74.51 108.968 170.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.543 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 80.8 mtt180 -80.82 100.69 8.94 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.21 -0.905 . . . . 75.13 109.076 174.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 35.9 t -92.38 111.12 23.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 108.356 -0.979 . . . . 75.22 108.356 173.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -77.84 126.02 30.22 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 108.801 -0.814 . . . . 75.12 108.801 167.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -129.78 156.32 44.52 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 108.941 -0.763 . . . . 72.43 108.941 174.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -116.95 106.86 13.88 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.444 1.098 . . . . 74.1 108.652 -174.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.803 HD11 ' HB3' ' A' ' 19' ' ' LEU . 6.9 tt -107.15 140.96 39.17 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 125.172 1.389 . . . . 72.35 108.532 -173.499 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.493 ' HA ' ' HA ' ' A' ' 52' ' ' LYS . 29.9 mtm180 . . . . . 0 N--CA 1.482 1.157 0 N-CA-C 109.49 -0.559 . . . . 75.24 109.49 178.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.493 ' HA ' ' HA ' ' A' ' 47' ' ' ARG . 39.1 ttpt . . . . . 0 N--CA 1.472 0.626 0 N-CA-C 109.56 -0.533 . . . . 72.33 109.56 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -125.3 149.37 48.13 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 123.647 0.779 . . . . 75.43 110.86 -174.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -90.04 118.75 29.83 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.407 -0.815 . . . . 75.52 109.894 176.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -109.14 167.22 10.26 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.929 0.892 . . . . 65.35 109.506 173.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 42.7 m -144.62 105.08 4.11 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 108.538 -0.912 . . . . 75.22 108.538 177.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 42.4 t -92.71 104.98 16.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.621 0 N-CA-C 108.234 -1.024 . . . . 73.02 108.234 179.045 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.543 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 32.1 mt-10 -78.35 106.57 10.37 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 113.88 -1.509 . . . . 73.43 108.58 179.273 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.58 ' HB ' HG12 ' A' ' 11' ' ' VAL . 47.0 t -115.3 113.19 42.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 C-N-CA 123.684 0.794 . . . . 74.11 109.518 -176.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.531 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 32.2 tt0 -102.93 149.37 24.59 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.884 0.874 . . . . 62.13 110.483 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -67.97 129.98 41.58 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.112 0.565 . . . . 74.42 111.05 179.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 56.8 tp60 -119.05 79.86 1.46 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.88 0.872 . . . . 75.12 109.005 175.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 70.46 -100.75 0.83 Allowed Glycine 0 CA--C 1.531 1.065 0 CA-C-N 115.671 -0.695 . . . . 73.13 112.514 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -99.13 -28.0 13.56 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.844 0.857 . . . . 71.42 110.667 -179.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.9 t -100.82 172.13 7.25 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.522 0.729 . . . . 74.01 110.462 -178.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 94.3 m95 -107.52 151.52 25.47 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.485 0.714 . . . . 73.1 109.23 173.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 14.7 t -137.46 149.09 46.58 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.854 0.462 . . . . 72.2 110.631 -179.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.54 HG23 ' HG3' ' A' ' 18' ' ' LYS . 67.2 t -92.46 111.34 24.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 C-N-CA 123.671 0.788 . . . . 75.55 109.639 -175.661 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.531 ' HD3' ' HB3' ' A' ' 60' ' ' GLU . 30.7 mmmt -69.85 -57.84 4.59 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.751 0.82 . . . . 75.44 110.42 177.247 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.0 tpt180 -160.39 135.93 8.16 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.934 -0.575 . . . . 74.43 111.222 -178.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.531 HD13 ' HB3' ' A' ' 18' ' ' LYS . 56.8 mt -89.11 103.84 14.37 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 N-CA-C 107.388 -1.338 . . . . 74.32 107.388 164.226 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 86.0 m -99.89 114.68 28.07 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.488 0.715 . . . . 63.23 109.558 178.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 65.9 ttt180 -72.77 144.9 47.4 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 108.885 -0.783 . . . . 75.24 108.885 169.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 12.2 t . . . . . 0 N--CA 1.475 0.821 0 N-CA-C 108.782 -0.821 . . . . 63.43 108.782 171.566 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.9 ttm . . . . . 0 N--CA 1.475 0.813 0 CA-C-O 118.583 -0.722 . . . . 73.35 109.422 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -57.43 91.9 0.05 OUTLIER 'Trans proline' 0 C--N 1.381 2.272 0 C-N-CA 122.522 2.148 . . . . 74.41 110.903 172.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 48.3 m -72.21 122.19 20.63 Favored 'General case' 0 C--N 1.344 0.365 0 CA-C-N 114.9 -1.045 . . . . 74.15 109.317 -176.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.412 ' O ' ' HD2' ' A' ' 8' ' ' LYS . 28.8 tp10 -52.32 -39.5 60.68 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 124.561 1.163 . . . . 75.41 111.783 -176.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -59.7 -41.03 89.86 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 124.377 1.048 . . . . 72.54 110.167 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.557 ' HA ' ' HD3' ' A' ' 9' ' ' ARG . 34.0 tt0 -74.01 -26.65 60.55 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 114.907 -1.042 . . . . 75.24 110.816 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.403 ' O ' HG23 ' A' ' 11' ' ' VAL . 30.2 mm-40 -64.83 -38.2 90.19 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 119.316 -0.373 . . . . 55.21 110.819 178.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.412 ' HD2' ' O ' ' A' ' 4' ' ' GLU . 1.4 mptp? -59.78 -45.94 90.74 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 109.503 -0.555 . . . . 65.21 109.503 174.126 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.557 ' HD3' ' HA ' ' A' ' 6' ' ' GLU . 74.4 mtp180 -54.36 -42.12 69.94 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 124.144 0.902 . . . . 72.05 111.082 -178.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -70.84 -52.62 19.19 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.754 0.821 . . . . 74.1 111.306 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.608 HG22 HD13 ' A' ' 40' ' ' ILE . 96.3 t -64.79 -44.99 96.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 124.015 0.926 . . . . 74.12 112.15 -171.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -68.28 -31.63 71.23 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 123.77 0.669 . . . . 71.44 110.704 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.475 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 8.9 tt0 -69.51 -46.35 66.76 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 123.753 0.658 . . . . 74.21 110.033 176.122 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.479 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 68.8 t -58.67 -45.24 90.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 123.032 0.533 . . . . 75.04 109.631 175.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.441 ' HB1' HD12 ' A' ' 44' ' ' LEU . . . -60.61 -48.43 81.8 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.614 1.165 . . . . 71.02 111.741 -176.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -67.74 -42.56 81.67 Favored 'General case' 0 C--N 1.351 0.639 0 O-C-N 123.63 0.581 . . . . 75.21 110.47 -178.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 63.3 mm-40 -63.64 -34.67 78.37 Favored 'General case' 0 C--N 1.357 0.932 0 O-C-N 123.62 0.575 . . . . 75.41 111.023 -177.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.479 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 65.9 mmtt -64.05 -40.93 97.38 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 123.654 0.596 . . . . 72.44 111.067 176.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.545 HD11 HG13 ' A' ' 28' ' ' VAL . 64.7 mt -70.41 -29.71 66.4 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 116.088 -0.506 . . . . 74.31 111.288 176.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 89.7 mt -77.65 -23.67 49.65 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.835 0.854 . . . . 65.44 110.556 175.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -74.04 -39.51 63.48 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.43 0.692 . . . . 75.35 109.543 172.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -73.38 -31.12 63.73 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 115.784 -0.643 . . . . 74.12 111.426 178.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.8 t -153.65 87.97 3.69 Favored Pre-proline 0 CA--C 1.56 1.362 0 C-N-CA 122.496 0.318 . . . . 54.43 110.307 -176.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -68.03 -17.13 45.96 Favored 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 123.658 2.905 . . . . 74.43 114.812 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -79.81 -17.46 53.29 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-O 121.03 0.443 . . . . 64.33 111.062 178.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 37.1 m -91.65 147.98 22.6 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.683 0.793 . . . . 73.41 111.443 -177.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -109.39 118.78 37.56 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 108.655 -0.868 . . . . 73.12 108.655 172.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.545 HG13 HD11 ' A' ' 19' ' ' LEU . 36.6 t -100.26 144.05 13.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 C-N-CA 124.02 0.928 . . . . 74.14 110.265 -175.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -132.58 147.96 52.36 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.342 1.057 . . . . 73.12 108.488 172.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 57.6 t -67.16 137.04 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.125 0.57 . . . . 75.22 109.975 177.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.8 tpt85 -115.7 -39.34 3.53 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.374 0.269 . . . . 74.51 110.965 -173.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.58 ' HB3' ' HB2' ' A' ' 43' ' ' GLU . 0.1 OUTLIER -167.8 144.46 4.17 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 108.551 -0.907 . . . . 74.01 108.551 -174.208 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.526 HG21 HG11 ' A' ' 42' ' ' VAL . 89.8 t -135.08 139.29 47.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 N-CA-C 108.838 -0.801 . . . . 74.45 108.838 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -135.35 113.69 11.47 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.902 0.881 . . . . 73.21 110.711 177.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.482 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 23.9 tptm -81.31 107.7 14.31 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 108.65 -0.871 . . . . 75.11 108.65 172.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -121.93 81.96 1.89 Allowed 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 108.681 -0.859 . . . . 71.24 108.681 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.482 ' O ' ' HE2' ' A' ' 35' ' ' LYS . . . 63.91 -125.65 32.98 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 111.521 -0.632 . . . . 44.12 111.521 -173.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -70.91 -30.47 66.81 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-N 117.524 0.662 . . . . 74.45 111.2 174.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 24.7 m -94.81 110.21 22.1 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 123.245 0.618 . . . . 73.43 111.798 -169.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.608 HD13 HG22 ' A' ' 11' ' ' VAL . 41.1 mt -95.57 113.5 30.1 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 123.799 0.84 . . . . 75.11 110.479 174.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 24.8 mtp-105 -87.88 101.56 13.85 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.286 0.634 . . . . 71.33 109.295 173.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.526 HG11 HG21 ' A' ' 33' ' ' VAL . 48.9 t -97.85 108.36 21.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 N-CA-C 108.763 -0.829 . . . . 73.41 108.763 176.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.58 ' HB2' ' HB3' ' A' ' 32' ' ' ARG . 51.9 mp0 -75.0 129.29 37.39 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 108.867 -0.79 . . . . 71.12 108.867 165.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.441 HD12 ' HB1' ' A' ' 15' ' ' ALA . 3.5 mp -122.72 168.29 12.4 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.878 -0.786 . . . . 72.14 108.878 172.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -126.41 108.63 11.39 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.297 -1.001 . . . . 74.4 108.297 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.416 HD11 ' HB3' ' A' ' 19' ' ' LEU . 6.8 tt -95.92 119.32 34.2 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.377 1.071 . . . . 75.41 108.112 -177.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 84.9 mtm180 -109.27 136.19 49.14 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.498 0.719 . . . . 74.23 109.914 -174.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.552 ' HB ' ' HB2' ' A' ' 51' ' ' LYS . 0.2 OUTLIER -144.71 176.88 9.11 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.634 1.174 . . . . 74.34 109.15 -176.09 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -62.63 98.42 0.12 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.847 0.859 . . . . 70.41 110.815 176.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 77.82 3.24 83.72 Favored Glycine 0 C--N 1.347 1.192 0 CA-C-N 115.746 -0.661 . . . . 71.43 113.868 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.552 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 44.2 mtpt -119.0 149.93 40.81 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.316 0.646 . . . . 73.11 110.317 177.414 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -150.47 99.68 2.79 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 107.223 -1.399 . . . . 75.42 107.223 167.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -104.48 114.82 29.31 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.222 0.609 . . . . 70.24 109.556 -174.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -75.39 117.98 17.78 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.645 -0.872 . . . . 65.14 108.645 171.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -105.92 170.46 7.89 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.646 0.778 . . . . 74.22 109.716 177.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 26.8 m -145.09 102.16 3.71 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 108.028 -1.101 . . . . 75.12 108.028 173.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.428 HG13 ' HA ' ' A' ' 15' ' ' ALA . 61.1 t -93.0 102.92 14.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 N-CA-C 107.019 -1.474 . . . . 71.13 107.019 178.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -89.19 105.3 17.7 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 114.298 -1.319 . . . . 71.14 108.14 -177.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.401 HG13 ' HB3' ' A' ' 66' ' ' TRP . 45.4 t -100.04 152.26 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 125.041 1.337 . . . . 73.54 109.52 -176.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -130.0 144.99 51.63 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.133 0.973 . . . . 75.33 110.207 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.8 tpt180 -81.33 113.04 19.16 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.774 0.83 . . . . 75.31 109.566 175.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 -120.42 100.63 7.27 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 107.998 -1.112 . . . . 74.43 107.998 170.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 72.49 -112.19 3.89 Favored Glycine 0 C--N 1.348 1.2 0 N-CA-C 111.368 -0.693 . . . . 54.33 111.368 -175.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -106.54 -16.13 14.61 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.571 0.748 . . . . 73.5 110.572 174.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 42.2 p -93.37 149.23 21.39 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 122.993 0.517 . . . . 75.35 111.166 -172.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . 0.401 ' HB3' HG13 ' A' ' 59' ' ' VAL . 99.1 m95 -103.25 116.22 32.04 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.226 1.01 . . . . 75.05 109.905 179.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.1 t -108.49 145.22 35.04 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.762 0.825 . . . . 54.45 110.435 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.453 HG23 ' HG3' ' A' ' 18' ' ' LYS . 88.7 t -86.23 113.02 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 O-C-N 121.856 -0.527 . . . . 73.11 109.908 179.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.465 ' HZ2' ' HB3' ' A' ' 69' ' ' LYS . 3.5 mmmp? -66.1 -47.47 74.09 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.913 0.885 . . . . 75.32 110.603 173.488 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -161.95 154.29 19.59 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.501 -0.772 . . . . 71.33 110.75 -178.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.445 HD13 ' HB3' ' A' ' 18' ' ' LYS . 80.3 mt -113.57 107.24 22.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 107.119 -1.438 . . . . 64.54 107.119 166.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 27.6 m -92.28 144.18 25.65 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.662 0.785 . . . . 72.32 109.063 178.112 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -116.18 148.48 40.32 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 107.21 -1.404 . . . . 74.51 107.21 170.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.1 t -59.6 135.4 57.66 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.452 0.701 . . . . 72.41 109.902 174.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 14.1 p -81.98 135.76 24.33 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 C-N-CA 123.219 0.608 . . . . 74.42 109.622 -177.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -102.62 150.14 17.9 Favored Glycine 0 C--N 1.344 0.985 0 C-N-CA 122.947 0.308 . . . . 54.41 112.492 -178.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 38.9 t -145.78 163.46 34.91 Favored 'General case' 0 C--O 1.248 1.026 0 C-N-CA 124.105 0.962 . . . . 73.52 109.003 175.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -66.4 134.45 52.54 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 108.977 -0.749 . . . . 71.5 108.977 172.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.26 -167.55 1.35 Allowed 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.79 0.836 . . . . 71.45 110.182 -173.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 79.0 t60 -121.49 117.64 27.34 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 107.598 -1.26 . . . . 73.51 107.598 168.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 52.8 m80 -61.96 121.62 13.44 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 109.423 -0.584 . . . . 71.22 109.423 177.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 17.5 t60 -71.75 -45.48 61.57 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.625 -0.88 . . . . 64.22 108.625 174.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 15.0 m-70 -87.07 127.34 35.12 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.072 -0.967 . . . . 74.21 109.071 175.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 60.1 m80 -121.75 137.9 54.58 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.297 1.039 . . . . 74.42 108.816 176.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 44.0 t-80 . . . . . 0 C--O 1.247 0.97 0 C-N-CA 123.741 0.816 . . . . 74.45 109.143 179.49 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 mmt . . . . . 0 N--CA 1.483 1.175 0 N-CA-C 110.116 -0.328 . . . . 75.32 110.116 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -72.43 111.9 3.33 Favored 'Trans proline' 0 C--N 1.374 1.904 0 C-N-CA 121.796 1.664 . . . . 74.35 111.087 174.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 64.6 m -113.66 149.64 34.37 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.585 0.754 . . . . 73.12 109.337 176.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -59.8 -30.54 68.98 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.56 0.744 . . . . 72.25 112.025 -175.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -75.7 -35.75 60.21 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.674 0.79 . . . . 72.45 110.645 177.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -70.52 -27.79 64.45 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.747 0.819 . . . . 73.41 110.662 173.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.529 ' O ' HG21 ' A' ' 11' ' ' VAL . 67.8 mm-40 -59.06 -47.31 85.69 Favored 'General case' 0 C--N 1.356 0.875 0 CA-C-O 118.745 -0.645 . . . . 73.2 110.696 -178.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.72 -35.46 72.71 Favored 'General case' 0 C--N 1.364 1.199 0 O-C-N 123.671 0.607 . . . . 72.21 111.022 177.279 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 20.9 mtm180 -65.55 -32.82 74.62 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 122.627 0.371 . . . . 73.42 110.902 178.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -74.36 -38.48 63.19 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 122.99 0.516 . . . . 75.15 110.555 174.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.611 HG23 HD12 ' A' ' 40' ' ' ILE . 58.5 t -70.11 -44.29 78.28 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 C-N-CA 123.493 0.717 . . . . 65.14 111.288 -176.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.458 ' HD3' HG21 ' A' ' 33' ' ' VAL . 45.7 mtmt -63.03 -37.35 86.82 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.911 0.884 . . . . 72.13 110.02 177.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.443 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.3 tt0 -63.28 -55.65 22.98 Favored 'General case' 0 C--N 1.353 0.729 0 O-C-N 124.408 1.067 . . . . 74.12 110.072 177.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.523 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 95.8 t -55.84 -44.24 76.99 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 O-C-N 123.515 0.51 . . . . 72.04 109.941 178.468 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.44 ' HA ' HG12 ' A' ' 57' ' ' VAL . . . -60.24 -45.78 92.07 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 124.561 1.144 . . . . 62.24 112.156 -177.647 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -74.47 -31.98 62.42 Favored 'General case' 0 C--N 1.349 0.582 0 CA-C-N 116.02 -0.536 . . . . 74.42 110.68 -177.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.445 ' O ' ' HG3' ' A' ' 21' ' ' GLU . 7.3 mm-40 -64.81 -38.39 90.82 Favored 'General case' 0 C--N 1.352 0.692 0 O-C-N 123.807 0.692 . . . . 75.31 110.014 176.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 29.0 mmmt -58.94 -49.89 76.14 Favored 'General case' 0 C--N 1.362 1.124 0 O-C-N 123.72 0.637 . . . . 74.42 110.617 176.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.633 ' HB3' HD11 ' A' ' 46' ' ' LEU . 53.1 mt -66.29 -29.26 69.44 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.227 -0.897 . . . . 75.44 112.194 -179.101 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.9 mt -78.86 -27.5 44.08 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.219 0.607 . . . . 75.22 111.078 176.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.445 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 52.7 mt-10 -70.94 -42.87 69.25 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 109.719 -0.474 . . . . 63.43 109.719 174.282 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.428 ' NE2' HD21 ' A' ' 19' ' ' LEU . 47.4 mt-30 -68.64 -41.85 78.83 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 115.168 -0.924 . . . . 74.23 111.001 178.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.2 t -145.58 91.51 5.72 Favored Pre-proline 0 CA--C 1.552 1.054 0 CA-C-N 115.662 -0.699 . . . . 73.21 109.453 -177.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -79.63 -2.85 12.52 Favored 'Trans proline' 0 C--N 1.378 2.102 0 C-N-CA 122.927 2.418 . . . . 71.44 112.15 174.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -95.26 13.93 23.96 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.399 1.08 . . . . 74.32 110.673 -178.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 60.1 p -135.21 148.87 49.77 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.048 0.539 . . . . 75.42 110.871 -175.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.406 ' HE2' ' HA ' ' A' ' 27' ' ' LYS . 11.1 mmpt? -90.3 114.63 26.73 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-O 121.256 0.551 . . . . 74.44 109.925 175.215 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 87.5 t -99.86 124.69 53.43 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 CA-C-N 114.29 -1.323 . . . . 74.42 109.252 -178.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -112.85 167.06 10.81 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.225 1.41 . . . . 64.24 108.157 174.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.403 HG23 ' HB3' ' A' ' 12' ' ' LYS . 87.6 t -104.96 110.92 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 N-CA-C 107.929 -1.137 . . . . 54.14 107.929 169.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -81.89 -43.82 17.65 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 122.767 0.427 . . . . 74.41 111.379 -171.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -162.78 146.21 11.14 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 108.168 -1.049 . . . . 74.41 108.168 -176.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.53 HG12 HG23 ' A' ' 42' ' ' VAL . 40.0 t -118.34 141.22 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 N-CA-C 108.892 -0.781 . . . . 74.32 108.892 177.175 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -135.83 112.74 10.28 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 122.988 0.515 . . . . 73.02 110.241 177.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.2 tmtp? -86.11 117.48 24.97 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 108.349 -0.982 . . . . 75.4 108.349 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -129.23 75.89 1.68 Allowed 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.464 0.706 . . . . 74.21 110.083 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 67.27 -96.99 0.35 Allowed Glycine 0 C--N 1.35 1.335 0 CA-C-N 115.274 -0.875 . . . . 74.31 113.971 173.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.685 ' HB3' ' HG3' ' A' ' 60' ' ' GLU . 16.7 m120 -80.24 -52.58 7.56 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 109.254 -0.647 . . . . 63.12 109.254 173.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 19.8 m -94.84 110.3 22.19 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 114.919 -1.037 . . . . 74.25 110.601 -168.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.611 HD12 HG23 ' A' ' 11' ' ' VAL . 41.9 mt -87.86 107.99 17.99 Favored 'Isoleucine or valine' 0 C--O 1.24 0.568 0 N-CA-C 108.541 -0.911 . . . . 73.3 108.541 169.563 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.563 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 86.8 mtt180 -82.97 96.54 8.35 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 109.0 -0.741 . . . . 74.12 109.0 174.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.53 HG23 HG12 ' A' ' 33' ' ' VAL . 40.7 t -88.29 114.11 26.31 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 107.832 -1.173 . . . . 74.05 107.832 174.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -85.94 107.16 17.6 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.907 0.883 . . . . 74.35 109.411 174.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.2 mp -99.43 170.51 8.57 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.689 0.796 . . . . 74.03 110.761 178.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -130.19 104.04 7.07 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.98 0.912 . . . . 73.11 109.37 -177.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.633 HD11 ' HB3' ' A' ' 19' ' ' LEU . 9.6 tt -104.58 143.96 32.35 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 108.432 -0.951 . . . . 74.52 108.432 -177.052 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 56.1 mtt85 -110.48 97.59 7.0 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 122.923 0.489 . . . . 61.23 110.814 -177.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 56.1 m -90.36 105.48 17.85 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.404 1.082 . . . . 74.35 109.472 179.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 65.78 27.31 11.16 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.2 1.0 . . . . 72.23 111.117 174.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 92.68 -12.95 68.66 Favored Glycine 0 C--N 1.35 1.343 0 CA-C-N 115.553 -0.749 . . . . 71.35 113.034 -177.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.414 ' HD2' ' N ' ' A' ' 51' ' ' LYS . 10.6 mptt -92.54 151.16 20.32 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.965 0.906 . . . . 73.22 109.487 178.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 33.9 ttpt -99.09 114.88 27.82 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.535 0.734 . . . . 75.21 111.734 -173.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -118.67 113.01 20.54 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 107.826 -1.176 . . . . 73.43 107.826 170.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -81.21 126.07 31.07 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.241 0.616 . . . . 74.14 110.031 177.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -113.06 118.73 35.6 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.198 0.599 . . . . 73.43 109.706 178.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 30.7 m -86.33 102.7 14.24 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.978 0.911 . . . . 63.13 109.093 174.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.458 HG13 HG12 ' A' ' 71' ' ' ILE . 56.0 t -91.54 105.91 17.06 Favored 'Isoleucine or valine' 0 C--O 1.243 0.733 0 N-CA-C 108.633 -0.877 . . . . 75.41 108.633 179.137 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.563 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 24.7 mt-10 -83.84 102.04 12.07 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 125.237 1.415 . . . . 52.32 108.985 -178.015 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.533 HG21 HG21 ' A' ' 68' ' ' VAL . 18.1 t -110.43 123.59 66.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 123.394 0.678 . . . . 71.1 109.373 -177.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.685 ' HG3' ' HB3' ' A' ' 38' ' ' ASN . 39.7 tt0 -102.97 142.97 33.17 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.123 0.969 . . . . 75.42 110.723 -175.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -79.96 111.72 16.57 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 123.584 0.754 . . . . 74.44 109.103 171.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 15.6 mm-40 -116.15 99.26 7.11 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 108.235 -1.024 . . . . 74.15 108.235 171.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.45 -106.07 1.69 Allowed Glycine 0 C--N 1.345 1.053 0 N-CA-C 111.115 -0.794 . . . . 62.44 111.115 -173.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -112.65 -17.57 12.56 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.014 0.926 . . . . 63.14 110.656 174.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 81.0 p -88.36 128.83 35.51 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 122.965 0.506 . . . . 74.45 110.279 -174.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.8 m95 -82.24 131.97 35.23 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.519 0.728 . . . . 73.51 109.287 172.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 8.8 t -132.67 121.12 22.66 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 123.442 0.697 . . . . 73.2 109.785 -175.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.533 HG21 HG21 ' A' ' 59' ' ' VAL . 97.7 t -74.32 104.02 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 123.605 0.762 . . . . 65.52 110.075 -179.244 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -70.0 -50.75 38.43 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.592 0.757 . . . . 74.52 110.754 -177.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 21.4 tpt180 -158.75 147.34 18.5 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.508 -0.769 . . . . 75.15 110.14 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.458 HG12 HG13 ' A' ' 57' ' ' VAL . 65.8 mt -110.55 105.73 19.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 N-CA-C 107.909 -1.145 . . . . 54.43 107.909 172.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 59.9 m -98.93 107.12 19.48 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.786 0.834 . . . . 74.11 110.302 -178.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 30.6 ttp180 -75.01 151.01 38.79 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.516 0.726 . . . . 74.22 110.439 175.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 15.1 t -77.71 151.47 34.16 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 123.399 0.68 . . . . 71.32 109.576 171.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 60.2 t -70.28 105.44 1.37 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.956 0 C-N-CA 123.192 0.597 . . . . 74.12 109.511 178.162 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 179.1 32.73 0.06 OUTLIER Glycine 0 C--N 1.351 1.37 0 O-C-N 123.381 0.426 . . . . 73.24 113.193 -178.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 24.7 m -75.61 140.26 42.52 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.408 0.683 . . . . 72.12 111.251 177.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.1 tt -78.93 102.78 8.46 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 108.38 -0.97 . . . . 73.45 108.38 174.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -67.8 120.28 13.88 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 109.04 -0.726 . . . . 63.44 109.04 174.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 31.4 m80 -81.22 92.16 6.29 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 123.306 0.642 . . . . 73.23 110.832 -169.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 35.0 m170 -73.99 120.54 19.71 Favored 'General case' 0 C--N 1.348 0.509 0 N-CA-C 108.643 -0.873 . . . . 72.51 108.643 173.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 16.1 p80 -115.5 119.19 35.37 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.4 0.68 . . . . 74.32 109.829 -175.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 11.3 t-80 -77.2 -31.37 55.23 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.394 1.078 . . . . 75.32 112.1 -175.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 12.1 p80 -95.47 178.08 5.61 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 122.309 0.243 . . . . 74.13 110.773 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 45.1 t-80 . . . . . 0 C--O 1.249 1.03 0 C-N-CA 123.146 0.578 . . . . 71.23 109.73 176.25 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.3 mmm . . . . . 0 N--CA 1.484 1.227 0 N-CA-C 109.56 -0.533 . . . . 73.33 109.56 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -55.61 92.78 0.04 OUTLIER 'Trans proline' 0 C--N 1.381 2.284 0 C-N-CA 122.433 2.089 . . . . 54.42 111.356 170.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 31.0 m -73.54 158.83 34.12 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-N 115.614 -0.721 . . . . 71.32 110.051 -179.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -64.47 -20.15 66.0 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 122.83 0.452 . . . . 53.04 111.747 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -89.86 -34.3 16.15 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 122.98 0.512 . . . . 74.41 111.15 172.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -66.95 -33.0 74.63 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.536 0.734 . . . . 64.5 111.442 -174.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.527 ' O ' HG23 ' A' ' 11' ' ' VAL . 12.2 pt-20 -59.39 -37.56 78.29 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 115.651 -0.704 . . . . 64.44 110.808 176.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.589 ' HG3' HG11 ' A' ' 33' ' ' VAL . 0.3 OUTLIER -54.84 -39.13 68.26 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 123.627 0.771 . . . . 75.31 111.142 177.925 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.8 mmm180 -62.39 -42.56 99.52 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.708 0.803 . . . . 75.33 109.93 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.423 ' O ' HG21 ' A' ' 14' ' ' VAL . 45.7 mm-40 -66.84 -43.08 84.62 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 114.729 -1.123 . . . . 74.33 110.937 177.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.58 HG22 HD13 ' A' ' 40' ' ' ILE . 63.7 t -67.89 -43.22 86.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 123.854 0.862 . . . . 72.14 111.655 -174.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -63.51 -31.91 73.21 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.029 0.531 . . . . 72.41 110.488 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.437 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 8.7 tt0 -66.71 -52.95 38.74 Favored 'General case' 0 C--N 1.349 0.554 0 O-C-N 123.847 0.717 . . . . 71.1 110.165 174.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.423 HG21 ' O ' ' A' ' 10' ' ' GLN . 66.1 t -59.71 -30.79 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 123.624 0.77 . . . . 74.04 110.804 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.498 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -76.17 -47.12 25.34 Favored 'General case' 0 C--O 1.248 0.992 0 C-N-CA 123.977 0.911 . . . . 73.52 111.992 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -70.59 -33.64 71.29 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 116.054 -0.521 . . . . 71.0 111.514 -172.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 23.1 mm-40 -65.92 -36.99 84.9 Favored 'General case' 0 C--N 1.353 0.753 0 O-C-N 123.789 0.68 . . . . 74.2 110.887 178.791 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.557 ' HG3' HG22 ' A' ' 68' ' ' VAL . 68.4 mmtt -60.66 -42.89 97.94 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 123.613 0.571 . . . . 70.5 111.303 176.502 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 51.4 mt -72.45 -30.23 64.4 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 115.756 -0.656 . . . . 70.13 111.859 178.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 68.8 mt -70.34 -27.38 64.31 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.204 0.602 . . . . 75.44 111.308 174.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 50.5 mt-10 -70.12 -35.05 73.83 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 120.947 0.403 . . . . 73.31 110.479 174.177 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -83.08 -24.98 32.45 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 115.61 -0.723 . . . . 72.03 111.664 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.0 t -158.56 93.61 1.95 Allowed Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 123.448 0.699 . . . . 74.33 109.394 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_endo -82.06 -9.45 11.76 Favored 'Trans proline' 0 C--N 1.373 1.828 0 C-N-CA 123.142 2.561 . . . . 74.11 113.683 -178.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -85.82 -6.18 59.14 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.263 0.625 . . . . 72.44 111.447 -178.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 64.6 p -114.37 140.54 48.57 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.198 0.999 . . . . 75.1 111.078 -175.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -80.15 127.61 32.52 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.903 -0.777 . . . . 75.15 108.903 171.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.557 HG23 HD12 ' A' ' 46' ' ' LEU . 39.6 t -98.71 112.67 31.4 Favored 'Isoleucine or valine' 0 C--O 1.239 0.532 0 O-C-N 123.535 0.522 . . . . 65.52 109.669 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -99.13 172.98 7.04 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.618 0.767 . . . . 71.42 109.394 175.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.7 p -98.3 132.87 42.47 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 N-CA-C 108.923 -0.769 . . . . 73.13 108.923 171.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.8 tpt180 -88.95 -47.44 8.14 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.399 0.68 . . . . 73.25 109.304 173.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.6 mtt180 -165.02 157.78 16.24 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.319 1.048 . . . . 71.14 109.755 175.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.589 HG11 ' HG3' ' A' ' 8' ' ' LYS . 73.0 t -116.49 110.27 30.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 N-CA-C 108.692 -0.855 . . . . 63.51 108.692 175.353 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -100.99 109.8 21.76 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.172 0.589 . . . . 75.13 109.435 -177.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.3 mmtt -79.69 136.29 36.75 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.915 0.886 . . . . 74.44 109.475 178.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -150.6 67.07 0.94 Allowed 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 107.928 -1.138 . . . . 73.13 107.928 -178.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 67.86 -135.24 30.28 Favored Glycine 0 C--N 1.349 1.277 0 CA-C-N 115.293 -0.867 . . . . 75.52 111.857 -173.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -76.45 -1.14 25.64 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.05 0.54 . . . . 72.03 111.856 176.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 55.1 m -99.84 141.66 32.36 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.462 0.705 . . . . 71.12 109.161 169.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.58 HD13 HG22 ' A' ' 11' ' ' VAL . 59.9 mt -129.79 117.4 41.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 C-N-CA 123.477 0.711 . . . . 75.52 109.222 171.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.421 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 9.8 mtp180 -81.91 97.9 8.28 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 108.684 -0.858 . . . . 74.22 108.684 169.031 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.6 t -80.71 114.19 21.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 N-CA-C 107.973 -1.121 . . . . 74.42 107.973 174.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -86.16 117.57 25.07 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 106.632 -1.618 . . . . 54.43 106.632 169.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.0 mp -111.92 169.84 8.56 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.054 0.454 . . . . 63.0 110.117 -179.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -141.58 107.64 5.19 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.696 0.76 . . . . 73.31 109.16 179.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.557 HD12 HG23 ' A' ' 28' ' ' VAL . 3.0 tt -113.21 135.52 53.73 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.522 1.529 . . . . 73.44 108.492 -173.131 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.427 ' HA ' ' O ' ' A' ' 51' ' ' LYS . 66.5 mtp180 -119.16 103.41 9.5 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-N 117.87 0.305 . . . . 73.43 111.463 -178.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 32.2 m -106.48 123.78 48.61 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.412 0.685 . . . . 73.55 109.982 177.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 62.92 20.22 12.09 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 124.218 1.007 . . . . 75.24 112.067 176.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.71 -21.45 45.88 Favored Glycine 0 C--N 1.35 1.317 0 CA-C-N 116.238 -0.437 . . . . 37.37 112.754 -176.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.427 ' O ' ' HA ' ' A' ' 47' ' ' ARG . 27.6 mmmt -70.68 124.14 23.56 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.395 0.678 . . . . 75.45 110.431 178.638 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -101.92 100.35 10.65 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 121.546 0.688 . . . . 75.31 109.655 -177.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -108.62 125.55 51.99 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 115.332 -0.849 . . . . 75.33 109.872 -175.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -78.72 146.06 34.14 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.199 0.523 . . . . 63.02 109.709 171.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -132.71 171.12 14.29 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.666 0.786 . . . . 74.1 109.507 177.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.685 ' HB ' ' HB ' ' A' ' 72' ' ' THR . 79.3 m -142.23 104.22 4.41 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 108.174 -1.047 . . . . 72.42 108.174 177.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.498 HG11 ' HA ' ' A' ' 15' ' ' ALA . 99.1 t -99.54 104.82 16.56 Favored 'Isoleucine or valine' 0 C--O 1.239 0.545 0 N-CA-C 107.726 -1.213 . . . . 75.33 107.726 174.281 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.421 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 31.5 mt-10 -82.59 100.21 10.01 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 114.007 -1.451 . . . . 70.14 108.618 -177.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.1 t -100.95 151.17 5.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 124.19 0.996 . . . . 74.42 109.132 -177.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -145.31 135.62 24.04 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 108.753 -0.832 . . . . 71.21 108.753 -175.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 31.1 ttp180 -80.29 133.27 35.95 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.152 0.581 . . . . 73.13 111.998 -172.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 64.3 mm-40 -121.08 109.24 14.8 Favored 'General case' 0 C--O 1.242 0.697 0 N-CA-C 107.515 -1.291 . . . . 73.04 107.515 175.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 67.88 -106.13 1.61 Allowed Glycine 0 C--N 1.345 1.029 0 N-CA-C 110.719 -0.953 . . . . 73.33 110.719 -171.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 54.3 t30 -110.41 -27.28 9.11 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.804 0.842 . . . . 73.25 110.022 172.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 33.9 p -77.75 172.52 13.29 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.163 0.585 . . . . 73.13 110.675 -177.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 89.0 m95 -125.76 146.68 49.67 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.376 0.67 . . . . 75.13 110.371 -175.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 6.1 t -137.75 144.07 41.48 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 122.892 0.477 . . . . 74.2 110.092 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.557 HG22 ' HG3' ' A' ' 18' ' ' LYS . 76.3 t -82.96 118.67 31.04 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 123.072 0.549 . . . . 74.5 109.86 177.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -88.62 -30.99 18.8 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 116.096 -0.502 . . . . 75.4 111.509 177.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 65.5 ttt-85 -158.66 137.17 10.94 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 120.527 0.204 . . . . 64.24 111.292 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 73.3 mt -103.02 131.18 51.88 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 N-CA-C 107.975 -1.121 . . . . 73.52 107.975 168.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.685 ' HB ' ' HB ' ' A' ' 56' ' ' THR . 27.8 m -128.1 150.2 50.07 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.203 1.001 . . . . 71.42 108.976 -177.455 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 27.4 ttp180 -126.41 145.37 50.49 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.079 0.952 . . . . 75.34 108.634 175.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.7 t -69.9 130.85 43.36 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-O 121.111 0.481 . . . . 54.21 110.053 177.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 2.5 p -101.23 103.65 15.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 N-CA-C 108.263 -1.014 . . . . 75.33 108.263 172.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -128.69 29.8 3.91 Favored Glycine 0 N--CA 1.472 1.047 0 CA-C-N 115.948 -0.569 . . . . 52.42 111.704 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 49.9 m -137.06 150.37 48.01 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.696 0.798 . . . . 74.3 109.719 -176.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 59.7 tp -73.62 104.31 4.52 Favored 'General case' 0 C--O 1.24 0.586 0 O-C-N 123.667 0.605 . . . . 72.14 109.624 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -77.87 137.29 38.3 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 123.829 0.852 . . . . 65.22 109.887 175.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -81.08 137.74 35.98 Favored 'General case' 0 C--O 1.241 0.622 0 N-CA-C 109.096 -0.705 . . . . 74.5 109.096 174.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 52.5 m80 -69.38 119.35 13.51 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 108.481 -0.933 . . . . 74.33 108.481 173.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 11.5 p80 -102.4 149.14 24.66 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 109.347 -0.612 . . . . 73.12 109.347 176.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 37.7 m80 -76.42 122.72 24.92 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 108.784 -0.821 . . . . 74.12 108.784 177.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -71.03 -29.09 64.92 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 109.654 -0.498 . . . . 72.14 109.654 174.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 . . . . . 0 C--O 1.249 1.067 0 CA-C-N 115.437 -0.801 . . . . 65.54 109.263 170.634 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.5 ttt . . . . . 0 N--CA 1.481 1.112 0 CA-C-O 118.934 -0.555 . . . . 73.21 110.005 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -64.09 91.82 0.17 Allowed 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.624 2.216 . . . . 74.13 112.259 175.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 39.4 t -152.89 160.45 43.06 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.223 1.009 . . . . 73.3 109.336 -179.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.86 -28.2 40.03 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 109.644 -0.502 . . . . 74.24 109.644 173.295 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -59.88 -34.66 73.45 Favored 'General case' 0 C--N 1.366 1.311 0 C-N-CA 123.973 0.909 . . . . 71.3 110.241 173.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -57.84 -41.6 82.67 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 124.583 1.177 . . . . 63.21 111.495 -177.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.526 ' O ' HG22 ' A' ' 11' ' ' VAL . 7.5 mm-40 -52.09 -52.41 51.46 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 124.295 0.997 . . . . 64.2 110.568 178.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.1 -43.2 96.1 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.17 -0.923 . . . . 74.32 109.811 -177.293 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 25.3 mtm180 -59.78 -35.12 73.99 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.6 0.76 . . . . 71.35 111.708 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.45 ' O ' HG22 ' A' ' 14' ' ' VAL . 46.8 mt-30 -75.12 -55.1 6.07 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.406 0.682 . . . . 74.41 110.511 179.085 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.57 HG13 ' HB ' ' A' ' 59' ' ' VAL . 42.8 t -62.73 -46.01 97.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 123.726 0.81 . . . . 74.23 111.766 -170.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -66.42 -33.4 75.63 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.135 0.574 . . . . 53.41 110.882 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -70.76 -44.34 66.94 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 123.603 0.564 . . . . 70.1 110.214 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.478 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 88.9 t -58.05 -50.35 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 N-CA-C 109.051 -0.722 . . . . 74.41 109.051 175.202 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.422 ' HB3' HD11 ' A' ' 44' ' ' LEU . . . -58.53 -45.91 87.89 Favored 'General case' 0 C--O 1.244 0.786 0 CA-C-N 114.368 -1.287 . . . . 73.2 112.292 -175.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.401 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 22.4 ptmt -69.45 -37.02 77.17 Favored 'General case' 0 C--N 1.353 0.749 0 O-C-N 123.525 0.515 . . . . 74.05 110.46 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.404 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 40.0 mt-10 -64.38 -34.03 77.23 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.319 0.647 . . . . 72.51 111.067 179.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.478 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 30.5 mmmt -69.87 -35.49 74.72 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.06 0.457 . . . . 74.32 110.504 178.088 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.735 ' HB3' HD13 ' A' ' 46' ' ' LEU . 41.7 mt -72.61 -23.57 60.96 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 115.257 -0.883 . . . . 74.31 111.299 173.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 96.4 mt -85.18 -17.66 36.47 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.986 0.914 . . . . 75.44 111.462 175.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.404 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 15.1 mm-40 -71.91 -44.13 64.2 Favored 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 108.467 -0.938 . . . . 72.25 108.467 169.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -78.52 -32.76 48.21 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 114.732 -1.122 . . . . 74.13 111.322 -177.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.554 ' HB2' HD11 ' A' ' 46' ' ' LEU . 49.0 m -154.83 80.9 4.38 Favored Pre-proline 0 CA--C 1.562 1.408 0 C-N-CA 123.854 0.861 . . . . 72.14 110.368 -173.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.2 -27.07 17.09 Favored 'Trans proline' 0 C--N 1.375 1.957 0 C-N-CA 122.722 2.282 . . . . 72.21 113.308 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -83.84 -9.67 58.59 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.343 0.657 . . . . 73.53 111.488 -177.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 38.0 m -89.34 145.98 25.0 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.274 0.63 . . . . 64.33 111.188 -177.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.29 109.18 20.1 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.6 0.76 . . . . 71.43 109.641 -178.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 64.5 t -97.61 122.0 48.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 C-N-CA 124.05 0.94 . . . . 63.42 109.249 -175.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 73.6 mm-40 -101.37 148.44 25.15 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.492 1.117 . . . . 74.35 108.686 177.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 59.0 t -78.58 106.98 10.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 N-CA-C 107.68 -1.23 . . . . 71.52 107.68 166.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.7 tpt180 -82.12 -61.68 1.84 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 122.609 0.364 . . . . 73.02 110.021 -177.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -147.47 170.05 18.22 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 125.177 1.391 . . . . 73.24 109.359 179.064 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.408 HG11 HG23 ' A' ' 42' ' ' VAL . 61.4 t -135.57 114.85 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 N-CA-C 108.134 -1.062 . . . . 70.22 108.134 173.218 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -107.88 110.81 22.67 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.534 0.734 . . . . 73.42 109.219 -179.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.47 ' HG2' HG12 ' A' ' 40' ' ' ILE . 2.5 tmtp? -92.43 108.74 20.19 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 108.602 -0.888 . . . . 74.14 108.602 -176.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -121.31 83.26 2.05 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.492 0.717 . . . . 72.53 110.026 -178.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.77 -108.96 2.66 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 115.206 -0.907 . . . . 72.23 112.889 178.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -93.34 -27.51 16.73 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.334 0.653 . . . . 70.5 110.2 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 32.6 m -93.11 97.72 10.85 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 123.6 0.76 . . . . 74.31 110.489 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.47 HG12 ' HG2' ' A' ' 35' ' ' LYS . 36.0 mt -86.19 107.45 16.58 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 N-CA-C 108.549 -0.908 . . . . 73.54 108.549 173.105 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 52.0 mtt85 -89.0 96.66 10.82 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.395 1.078 . . . . 74.34 109.797 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.408 HG23 HG11 ' A' ' 33' ' ' VAL . 57.3 t -80.82 124.45 38.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 108.575 -0.898 . . . . 74.03 108.575 175.357 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -90.94 124.09 34.94 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 107.966 -1.124 . . . . 72.15 107.966 174.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.422 HD11 ' HB3' ' A' ' 15' ' ' ALA . 2.0 mp -128.43 150.01 50.31 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 109.156 -0.683 . . . . 74.22 109.156 -179.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -108.81 106.04 15.88 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.376 0.608 . . . . 60.44 109.567 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.735 HD13 ' HB3' ' A' ' 19' ' ' LEU . 9.3 tt -92.68 109.11 20.53 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 107.527 -1.286 . . . . 75.31 107.527 -177.032 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -101.86 124.27 47.21 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.371 1.068 . . . . 71.34 109.59 -175.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.417 ' HB ' ' HB2' ' A' ' 51' ' ' LYS . 4.1 m -126.04 168.99 13.21 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 107.924 -1.139 . . . . 54.41 107.924 176.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -62.85 101.34 0.26 Allowed 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 118.184 0.447 . . . . 72.02 110.755 177.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 95.71 -8.82 68.6 Favored Glycine 0 C--N 1.345 1.045 0 CA-C-N 115.662 -0.699 . . . . 64.52 113.397 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.417 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 43.2 mtmt -114.8 142.0 47.13 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 117.529 0.664 . . . . 75.03 110.8 177.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -136.39 97.99 3.72 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 106.32 -1.733 . . . . 75.15 106.32 168.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -114.19 141.46 47.5 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.66 0.784 . . . . 70.04 109.641 -171.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -111.96 117.0 31.51 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 108.877 -0.786 . . . . 54.15 108.877 174.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -108.1 120.6 42.8 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.65 1.18 . . . . 75.03 110.095 178.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 32.9 m -88.94 101.44 14.07 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 108.775 -0.824 . . . . 73.15 108.775 168.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.516 HG12 HG12 ' A' ' 71' ' ' ILE . 43.0 t -91.88 106.62 17.91 Favored 'Isoleucine or valine' 0 C--O 1.243 0.746 0 N-CA-C 108.554 -0.906 . . . . 72.41 108.554 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -77.38 102.91 7.02 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 114.258 -1.337 . . . . 75.44 108.831 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.57 ' HB ' HG13 ' A' ' 11' ' ' VAL . 27.0 t -111.37 130.31 65.11 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 C-N-CA 123.809 0.844 . . . . 65.31 108.893 -178.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -120.2 141.15 50.17 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.252 0.621 . . . . 74.03 110.758 -173.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -74.59 116.33 15.16 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.487 0.715 . . . . 73.31 110.492 176.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 36.1 mm-40 -117.21 107.28 14.25 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.223 1.009 . . . . 73.05 108.623 171.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 63.18 -115.24 7.75 Favored Glycine 0 C--N 1.348 1.227 0 N-CA-C 111.124 -0.79 . . . . 52.3 111.124 -172.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -91.68 -32.21 15.53 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.504 0.721 . . . . 71.32 109.934 171.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 82.0 p -82.64 173.02 12.31 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.534 0.733 . . . . 75.13 112.129 -168.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -128.66 110.92 12.64 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.141 0.976 . . . . 75.12 110.365 -174.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.3 t -93.39 160.65 14.72 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.332 0.653 . . . . 61.22 110.672 177.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.466 HG21 ' HG3' ' A' ' 18' ' ' LYS . 48.1 t -100.42 120.86 50.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 123.203 0.601 . . . . 74.13 109.447 174.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -83.47 -53.07 5.97 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 123.938 0.895 . . . . 75.01 110.618 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 21.5 tpp180 -165.27 144.16 6.47 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.161 0.584 . . . . 72.05 110.422 177.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.516 HG12 HG12 ' A' ' 57' ' ' VAL . 59.2 mt -103.73 105.94 19.31 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 N-CA-C 107.934 -1.136 . . . . 74.44 107.934 172.032 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 57.4 m -97.98 103.89 15.87 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.621 0.769 . . . . 72.53 109.216 -178.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 36.3 ttp180 -85.93 147.4 26.26 Favored 'General case' 0 C--O 1.243 0.724 0 N-CA-C 109.501 -0.555 . . . . 75.32 109.501 175.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 10.0 t -61.89 136.77 58.11 Favored 'General case' 0 CA--C 1.554 1.118 0 O-C-N 123.771 0.669 . . . . 72.44 110.151 171.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 47.4 t -77.03 101.8 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 N-CA-C 108.834 -0.802 . . . . 63.15 108.834 -179.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -69.93 -52.22 20.32 Favored Glycine 0 C--N 1.351 1.382 0 CA-C-N 116.248 -0.433 . . . . 72.02 112.319 -179.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 28.0 m -117.02 111.35 19.43 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 124.302 1.041 . . . . 74.31 108.707 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 53.1 tp -77.62 103.49 7.59 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 109.565 -0.532 . . . . 74.02 109.565 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -77.15 87.37 3.62 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.492 -0.777 . . . . 74.24 109.264 176.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 55.2 t60 -139.08 142.17 38.15 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.535 0.734 . . . . 73.45 109.503 -176.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 -76.47 141.87 41.17 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.95 0.9 . . . . 74.23 110.581 -176.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 75.6 m-70 -86.88 146.21 26.28 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.158 0.583 . . . . 70.55 110.547 -179.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 10.9 p-80 -76.21 159.18 30.9 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.283 0.633 . . . . 74.12 110.676 176.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 47.2 m80 -84.32 -67.32 0.8 Allowed 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 108.632 -0.877 . . . . 71.03 108.632 172.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 . . . . . 0 C--O 1.254 1.333 0 N-CA-C 108.033 -1.099 . . . . 71.23 108.033 177.643 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 mpp? . . . . . 0 N--CA 1.482 1.169 0 N-CA-C 109.813 -0.439 . . . . 72.31 109.813 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -60.72 112.66 1.41 Allowed 'Trans proline' 0 C--N 1.377 2.077 0 C-N-CA 122.593 2.195 . . . . 73.14 111.732 170.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 46.5 p -89.66 31.5 0.93 Allowed 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.574 0.75 . . . . 53.23 111.483 -178.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -72.22 -46.08 57.64 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.002 0.921 . . . . 63.33 109.502 -173.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -69.66 -33.81 73.11 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.772 0.829 . . . . 75.41 110.882 176.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -57.51 -36.23 71.28 Favored 'General case' 0 C--N 1.358 0.955 0 C-N-CA 123.865 0.866 . . . . 74.43 111.672 -176.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.452 ' O ' HG21 ' A' ' 11' ' ' VAL . 44.7 mt-10 -52.4 -52.57 53.09 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 124.322 1.014 . . . . 72.41 110.448 175.609 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.452 ' O ' ' HG3' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -62.38 -42.42 99.4 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 124.545 1.153 . . . . 70.11 109.529 -175.731 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -59.58 -42.66 93.01 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.145 0.978 . . . . 75.42 110.567 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 61.7 mt-30 -66.44 -49.79 65.53 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.218 1.007 . . . . 72.33 110.874 177.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.521 HG23 HD12 ' A' ' 40' ' ' ILE . 86.4 t -67.52 -35.27 72.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 124.012 0.925 . . . . 75.12 112.111 -170.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.452 ' HG3' ' O ' ' A' ' 8' ' ' LYS . 53.4 mtmt -60.75 -36.36 78.72 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 122.704 0.402 . . . . 72.41 110.513 176.36 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.45 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 9.8 tt0 -71.39 -49.55 40.95 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 115.421 -0.809 . . . . 75.42 110.07 176.087 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.509 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 67.7 t -55.43 -40.25 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 123.396 0.678 . . . . 62.12 110.487 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.73 -47.64 58.67 Favored 'General case' 0 C--O 1.245 0.865 0 C-N-CA 124.603 1.161 . . . . 74.34 111.745 -176.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -66.83 -33.92 76.67 Favored 'General case' 0 C--N 1.358 0.952 0 CA-C-N 116.134 -0.485 . . . . 72.4 110.714 -176.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 13' ' ' GLN . 53.0 mt-10 -61.18 -41.33 96.61 Favored 'General case' 0 C--N 1.36 1.047 0 O-C-N 124.064 0.852 . . . . 73.13 110.599 179.201 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.587 ' HG3' HG22 ' A' ' 68' ' ' VAL . 71.8 mmtt -68.25 -35.2 77.54 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 123.802 0.689 . . . . 72.31 110.825 -178.337 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 77.6 mt -70.08 -30.04 67.18 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.107 0.563 . . . . 74.11 111.535 173.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 95.1 mt -81.38 -16.77 51.24 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.667 0.787 . . . . 75.31 110.737 175.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -81.2 -46.1 15.36 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 109.427 -0.582 . . . . 73.3 109.427 172.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -71.85 -24.34 61.67 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.291 0.636 . . . . 73.54 111.319 178.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 t -158.01 82.83 2.83 Favored Pre-proline 0 CA--C 1.558 1.273 0 O-C-N 123.421 0.45 . . . . 64.24 110.138 -178.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -61.37 -33.57 88.63 Favored 'Trans proline' 0 C--N 1.381 2.282 0 C-N-CA 123.411 2.741 . . . . 75.32 115.01 -177.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -76.14 -18.45 59.12 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 122.815 0.446 . . . . 65.24 112.103 -175.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 58.3 m -76.64 148.68 36.75 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.381 0.672 . . . . 74.11 111.797 -177.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.51 ' HE3' ' HA ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -103.34 116.33 32.24 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.913 0.885 . . . . 72.34 109.77 174.107 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 51.1 t -99.36 141.24 17.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 CA-C-N 114.705 -1.134 . . . . 75.11 109.525 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -131.63 110.78 11.17 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 108.005 -1.109 . . . . 75.12 108.005 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.436 HG23 ' HB3' ' A' ' 12' ' ' LYS . 73.9 t -58.73 114.57 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 N-CA-C 109.434 -0.58 . . . . 73.14 109.434 178.106 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -92.29 -46.64 7.61 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 123.882 0.739 . . . . 74.1 110.756 -171.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 21.0 tpt180 -157.24 155.33 30.63 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.455 0.702 . . . . 72.23 109.951 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 89.9 t -126.42 141.46 45.83 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 124.33 1.052 . . . . 73.01 109.43 176.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 74.2 mm-40 -128.01 109.17 11.3 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 124.353 1.061 . . . . 65.04 108.931 177.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -92.12 110.72 22.1 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 108.084 -1.08 . . . . 71.52 108.084 178.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -122.9 90.28 3.26 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.314 0.646 . . . . 73.1 110.104 -179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.56 -81.95 0.95 Allowed Glycine 0 C--N 1.35 1.352 0 CA-C-N 116.246 -0.433 . . . . 70.42 112.485 177.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -142.86 1.07 1.27 Allowed 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.695 1.198 . . . . 74.5 110.61 169.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 23.5 m -98.13 97.76 9.15 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.755 -0.831 . . . . 72.1 108.755 174.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.521 HD12 HG23 ' A' ' 11' ' ' VAL . 32.5 mt -92.49 107.66 19.27 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 C-N-CA 123.371 0.669 . . . . 74.3 110.067 178.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.515 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 94.3 mtt180 -87.41 105.26 17.15 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.389 1.076 . . . . 73.35 109.304 174.592 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 50.1 t -96.98 119.51 45.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 N-CA-C 109.086 -0.709 . . . . 74.33 109.086 175.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.476 ' HB3' HD22 ' A' ' 54' ' ' ASN . 7.1 mp0 -83.16 116.58 22.42 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 108.62 -0.882 . . . . 72.44 108.62 170.126 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.4 mp -116.23 153.64 31.51 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 109.088 -0.708 . . . . 75.34 109.088 176.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -115.76 104.23 11.46 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 124.191 0.996 . . . . 74.02 108.474 -171.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.0 tt -98.95 111.15 23.63 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 108.36 -0.978 . . . . 75.22 108.36 -173.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 57.4 mtt85 -101.3 125.98 48.0 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.664 0.786 . . . . 74.31 110.152 -176.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 90.1 m -148.51 127.34 12.62 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.907 1.283 . . . . 62.03 109.295 -179.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 63.9 21.72 12.74 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 124.828 1.251 . . . . 73.12 112.444 175.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 92.35 -20.34 44.44 Favored Glycine 0 C--N 1.347 1.17 0 CA-C-O 120.13 -0.261 . . . . 53.41 112.466 -176.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -76.48 166.02 23.99 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.979 0.912 . . . . 75.12 110.342 173.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.3 pttt -144.99 141.25 28.78 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.339 0.656 . . . . 75.44 109.669 172.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 49.8 mm-40 -127.38 119.62 26.61 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 107.89 -1.152 . . . . 62.55 107.89 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.476 HD22 ' HB3' ' A' ' 43' ' ' GLU . 8.2 t-20 -83.13 119.19 24.2 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 108.651 -0.87 . . . . 73.24 108.651 175.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -107.88 117.69 34.77 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 124.017 0.927 . . . . 72.01 109.303 177.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 59.0 m -84.43 100.43 11.32 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 107.909 -1.145 . . . . 72.25 107.909 168.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.428 HG21 HG21 ' A' ' 71' ' ' ILE . 57.6 t -91.99 103.83 14.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.447 0 N-CA-C 108.082 -1.081 . . . . 75.23 108.082 -179.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.515 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 30.1 mt-10 -79.01 102.13 8.18 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 114.57 -1.195 . . . . 75.44 108.723 -178.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.66 HG22 HG21 ' A' ' 68' ' ' VAL . 58.7 t -104.39 143.41 16.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 124.275 1.03 . . . . 74.42 108.894 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -136.14 147.83 47.92 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.462 0.705 . . . . 74.3 110.208 -179.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.5 tpp180 -76.57 117.58 18.36 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.785 0.834 . . . . 73.35 110.171 177.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -119.0 126.56 52.02 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 107.592 -1.262 . . . . 71.41 107.592 168.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 65.54 -104.5 1.0 Allowed Glycine 0 C--N 1.346 1.118 0 N-CA-C 111.122 -0.791 . . . . 72.12 111.122 -172.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -127.16 -5.06 6.14 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.89 0.876 . . . . 73.43 110.075 174.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 77.6 p -102.38 174.7 5.79 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.503 0.721 . . . . 73.31 111.171 -176.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -112.39 133.75 54.3 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.557 1.143 . . . . 74.41 110.637 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.1 t -128.23 151.99 48.62 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.26 1.024 . . . . 74.42 108.932 177.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.66 HG21 HG22 ' A' ' 59' ' ' VAL . 77.9 t -92.52 119.25 39.78 Favored 'Isoleucine or valine' 0 C--O 1.241 0.61 0 N-CA-C 109.941 -0.392 . . . . 74.23 109.941 175.312 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -70.07 -56.79 6.0 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 114.813 -1.085 . . . . 74.54 110.607 173.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -160.62 139.23 10.16 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 123.625 0.578 . . . . 64.4 110.02 178.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.428 HG21 HG21 ' A' ' 57' ' ' VAL . 59.3 mt -89.9 105.43 16.13 Favored 'Isoleucine or valine' 0 C--O 1.239 0.517 0 N-CA-C 107.975 -1.12 . . . . 73.54 107.975 168.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 96.1 m -97.14 105.85 18.08 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.485 0.714 . . . . 75.33 109.762 175.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 12.8 ttp180 -71.22 149.28 46.43 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 109.192 -0.67 . . . . 75.3 109.192 172.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 12.0 t -68.61 153.55 43.57 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 109.423 -0.584 . . . . 74.52 109.423 175.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 7.7 p -104.73 146.26 12.2 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 123.389 0.676 . . . . 74.23 109.341 179.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -148.9 138.73 7.08 Favored Glycine 0 C--N 1.337 0.608 0 N-CA-C 109.952 -1.259 . . . . 74.11 109.952 175.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 77.6 p -71.17 116.4 11.43 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.141 0.577 . . . . 72.4 110.213 -175.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.7 tt -106.46 49.7 0.8 Allowed 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 106.8 -1.555 . . . . 71.22 106.8 176.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.14 153.61 37.21 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 114.611 -1.177 . . . . 73.04 109.978 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 51.8 m80 -122.37 125.69 46.43 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 108.449 -0.945 . . . . 73.45 108.449 177.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -92.98 118.97 31.76 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 108.076 -1.083 . . . . 73.13 108.076 176.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -102.2 125.75 48.98 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 109.361 -0.607 . . . . 75.41 109.361 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 14.9 p80 -88.09 2.78 51.18 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.594 0.758 . . . . 65.21 111.512 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 69.0 t60 -103.26 115.68 31.02 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.841 0.856 . . . . 64.35 109.316 174.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 56.6 t-80 . . . . . 0 CA--C 1.557 1.244 0 N-CA-C 109.386 -0.598 . . . . 73.43 109.386 173.618 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 N--CA 1.485 1.288 0 CA-C-O 118.449 -0.786 . . . . 74.45 109.583 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_endo -44.01 110.54 0.21 Allowed 'Trans proline' 0 C--N 1.393 2.891 0 C-N-CA 124.126 3.217 . . . . 73.11 113.946 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 26.5 t -155.93 134.74 11.88 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.242 1.417 . . . . 72.54 107.466 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.57 ' HG2' ' HZ3' ' A' ' 8' ' ' LYS . 20.4 tt0 -60.74 -29.0 69.12 Favored 'General case' 0 N--CA 1.481 1.088 0 O-C-N 123.41 0.444 . . . . 74.25 112.079 -170.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -64.88 -45.99 83.66 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.99 0.916 . . . . 75.45 110.676 173.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -66.75 -26.48 67.0 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.397 1.079 . . . . 72.22 110.626 177.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.521 ' O ' HG21 ' A' ' 11' ' ' VAL . 20.2 mm-40 -64.36 -39.73 94.45 Favored 'General case' 0 C--O 1.207 -1.162 0 CA-C-O 118.008 -0.996 . . . . 75.03 111.06 178.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.57 ' HZ3' ' HG2' ' A' ' 4' ' ' GLU . 12.3 mptt -59.55 -36.4 76.11 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-N 119.319 0.963 . . . . 75.23 110.956 176.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -59.51 -31.33 69.27 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.281 0.632 . . . . 75.1 110.694 176.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.42 ' O ' HG21 ' A' ' 14' ' ' VAL . 38.3 mt-30 -82.45 -47.61 12.04 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 115.444 -0.798 . . . . 65.22 111.887 174.326 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.551 HG23 HD12 ' A' ' 40' ' ' ILE . 73.1 t -73.1 -45.5 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.186 0 C-N-CA 123.783 0.833 . . . . 72.21 112.08 -165.312 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.61 ' HD2' HG13 ' A' ' 30' ' ' VAL . 25.8 mtmm -69.43 -26.16 64.47 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 109.565 -0.532 . . . . 64.42 109.565 179.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.424 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 23.0 tt0 -71.34 -44.84 64.31 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.2 1.0 . . . . 63.41 110.318 176.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.458 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 82.6 t -61.51 -48.14 90.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 N-CA-C 108.85 -0.796 . . . . 72.53 108.85 174.341 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.9 -39.84 93.36 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.49 1.116 . . . . 75.24 112.228 -174.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -69.94 -38.05 76.07 Favored 'General case' 0 C--N 1.355 0.826 0 O-C-N 123.263 0.352 . . . . 74.24 110.278 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 28.2 mm-40 -68.23 -34.8 76.89 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 122.743 0.417 . . . . 74.5 110.618 177.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.537 ' HB3' HD11 ' A' ' 71' ' ' ILE . 31.7 mmmt -63.84 -33.0 74.71 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 122.952 0.501 . . . . 70.33 110.813 176.139 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.762 ' HB3' HD13 ' A' ' 46' ' ' LEU . 32.6 mt -76.15 -36.97 58.53 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.733 -0.667 . . . . 73.31 111.532 174.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.0 mt -73.58 -16.38 61.25 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.251 0.62 . . . . 74.43 111.614 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -61.77 -39.5 91.86 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.433 0.635 . . . . 73.23 110.508 167.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.47 HE22 HG22 ' A' ' 71' ' ' ILE . 42.9 mt-30 -84.8 -34.25 22.79 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 114.445 -1.252 . . . . 64.14 110.976 -175.524 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.406 ' HB3' HD11 ' A' ' 46' ' ' LEU . 15.2 t -153.03 88.81 3.77 Favored Pre-proline 0 CA--C 1.555 1.159 0 N-CA-C 109.169 -0.678 . . . . 74.34 109.169 -177.411 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -62.54 -44.57 17.33 Favored 'Trans proline' 0 C--N 1.384 2.418 0 C-N-CA 123.425 2.75 . . . . 72.3 114.36 -176.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -83.15 -2.99 56.88 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.359 0.663 . . . . 74.23 112.006 -171.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.6 t -83.74 158.39 21.79 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 122.922 0.489 . . . . 71.31 111.218 177.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.538 ' HZ2' ' HB2' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -92.34 134.13 35.2 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 123.481 0.712 . . . . 72.42 109.86 177.677 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.439 ' HA ' ' O ' ' A' ' 45' ' ' GLU . 80.9 t -117.21 113.98 44.35 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 C-N-CA 123.522 0.729 . . . . 73.12 109.912 177.215 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -109.48 122.12 46.7 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.459 1.104 . . . . 61.04 109.062 172.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.61 HG13 ' HD2' ' A' ' 12' ' ' LYS . 57.5 t -65.79 116.33 4.92 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 N-CA-C 109.238 -0.653 . . . . 75.32 109.238 176.042 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.0 tpt180 -83.14 -51.89 7.11 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.389 0.676 . . . . 64.4 110.267 -174.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 37.1 mtp85 -146.0 156.4 43.47 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.6 1.16 . . . . 72.24 109.67 -177.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 75.1 t -132.64 117.62 31.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 C-N-CA 123.891 0.876 . . . . 70.12 108.839 175.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -112.91 128.44 56.47 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.21 0.604 . . . . 74.31 110.033 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.5 tptp -108.66 109.76 21.03 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.296 1.039 . . . . 74.21 108.792 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.0 mm-40 -132.1 103.17 6.12 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.426 0.69 . . . . 72.33 109.953 -178.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.34 -101.99 0.89 Allowed Glycine 0 C--N 1.356 1.676 0 CA-C-N 115.92 -0.582 . . . . 74.12 112.519 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -113.22 -23.22 10.07 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.524 0.73 . . . . 75.12 109.715 173.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 16.6 m -85.14 105.71 16.06 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.491 0.716 . . . . 65.21 110.437 -176.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.551 HD12 HG23 ' A' ' 11' ' ' VAL . 31.2 mt -85.46 108.1 16.86 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 N-CA-C 109.29 -0.633 . . . . 73.15 109.29 168.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 -87.71 95.93 10.25 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 108.458 -0.942 . . . . 75.21 108.458 175.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.5 t -88.15 118.38 33.66 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 N-CA-C 108.824 -0.806 . . . . 75.53 108.824 179.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -90.3 120.85 31.79 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 108.605 -0.887 . . . . 73.21 108.605 173.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.5 mp -122.44 170.05 10.36 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 109.728 -0.471 . . . . 74.35 109.728 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.567 ' HG3' ' HG3' ' A' ' 52' ' ' LYS . 29.4 tt0 -120.7 105.16 10.51 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.48 1.112 . . . . 73.11 108.695 -176.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.762 HD13 ' HB3' ' A' ' 19' ' ' LEU . 6.9 tt -107.27 133.83 51.25 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 106.402 -1.703 . . . . 73.53 106.402 172.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 87.1 mtt180 -99.86 96.84 7.84 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.834 0.826 . . . . 74.51 109.66 -174.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 30.2 m -89.76 115.83 27.4 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 114.669 -1.15 . . . . 75.21 109.032 -175.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 64.87 17.75 11.16 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.379 1.072 . . . . 74.52 111.103 -178.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 96.32 -16.96 60.15 Favored Glycine 0 C--N 1.353 1.491 0 CA-C-N 116.196 -0.456 . . . . 64.04 112.917 -175.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -79.39 145.49 33.35 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.738 0.815 . . . . 75.22 110.998 178.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.583 ' HE2' HD22 ' A' ' 54' ' ' ASN . 84.4 tttt -79.64 108.33 13.1 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 122.849 0.46 . . . . 74.14 109.766 175.382 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -111.89 118.87 36.71 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 107.851 -1.166 . . . . 71.4 107.851 172.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.583 HD22 ' HE2' ' A' ' 52' ' ' LYS . 43.6 m-80 -88.06 132.9 34.11 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 109.878 -0.415 . . . . 73.21 109.878 177.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.435 ' CE2' ' HB3' ' A' ' 46' ' ' LEU . 66.6 m-85 -124.07 119.8 30.55 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 109.167 -0.679 . . . . 63.43 109.167 178.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 26.7 m -87.11 101.9 13.93 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 108.507 -0.923 . . . . 51.5 108.507 173.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.449 HG21 HG23 ' A' ' 71' ' ' ILE . 46.3 t -92.04 104.6 15.75 Favored 'Isoleucine or valine' 0 C--O 1.24 0.595 0 N-CA-C 108.007 -1.109 . . . . 74.11 108.007 177.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -80.93 105.24 12.01 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 114.511 -1.222 . . . . 75.55 109.344 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 20.8 t -112.91 134.57 55.11 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 108.806 -0.812 . . . . 75.54 108.806 178.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -121.95 142.71 50.02 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.302 0.641 . . . . 64.35 111.183 -174.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.85 114.92 19.14 Favored 'General case' 0 C--N 1.35 0.596 0 C-N-CA 123.787 0.835 . . . . 74.13 109.53 174.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -120.84 102.92 8.69 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 107.647 -1.242 . . . . 65.41 107.647 172.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 72.66 -99.53 0.92 Allowed Glycine 0 C--N 1.347 1.177 0 N-CA-C 110.211 -1.156 . . . . 74.43 110.211 -172.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -122.48 -19.19 6.45 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.303 1.041 . . . . 72.02 110.261 169.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 68.1 p -76.79 136.97 38.99 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 122.911 0.485 . . . . 75.22 111.364 -175.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -96.23 111.81 23.75 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.07 0.948 . . . . 75.23 109.891 177.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.2 t -105.01 139.73 39.25 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.734 0.814 . . . . 75.14 109.844 -177.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.463 HG23 ' HG3' ' A' ' 18' ' ' LYS . 59.0 t -91.14 116.65 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 O-C-N 121.709 -0.619 . . . . 72.33 110.379 177.198 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -71.37 -57.38 4.51 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.532 1.133 . . . . 55.45 111.091 175.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -162.09 133.53 5.29 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.584 -0.734 . . . . 52.23 109.844 -173.031 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.537 HD11 ' HB3' ' A' ' 18' ' ' LYS . 56.5 mt -91.48 105.21 16.3 Favored 'Isoleucine or valine' 0 C--O 1.241 0.614 0 N-CA-C 106.636 -1.616 . . . . 73.33 106.636 163.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 27.2 m -101.25 108.46 20.12 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.108 -0.701 . . . . 75.51 109.108 -176.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -67.54 138.67 56.68 Favored 'General case' 0 C--O 1.241 0.625 0 N-CA-C 108.81 -0.811 . . . . 74.43 108.81 171.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.1 t -60.02 156.53 14.59 Favored 'General case' 0 C--O 1.247 0.934 0 C-N-CA 123.58 0.752 . . . . 73.25 110.605 175.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 85.0 t -61.42 99.72 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.348 0.5 0 N-CA-C 108.826 -0.805 . . . . 72.23 108.826 177.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -96.98 -139.12 10.45 Favored Glycine 0 C--N 1.34 0.795 0 CA-C-N 115.024 -0.989 . . . . 74.01 111.064 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 31.4 t -154.1 162.22 41.35 Favored 'General case' 0 C--O 1.248 1.015 0 N-CA-C 108.437 -0.949 . . . . 53.34 108.437 176.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.0 pp -57.92 137.17 56.98 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 109.436 -0.579 . . . . 72.32 109.436 172.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -78.35 148.67 33.65 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 109.747 -0.464 . . . . 75.31 109.747 -175.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -63.59 104.95 0.71 Allowed 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 107.99 -1.115 . . . . 73.41 107.99 174.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 35.2 p-80 -61.34 118.38 6.85 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 124.277 0.985 . . . . 74.51 111.822 -167.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 32.9 p-80 -78.91 -9.66 59.57 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 115.047 -0.979 . . . . 70.24 110.154 172.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 81.2 t60 -57.9 109.09 0.67 Allowed 'General case' 0 C--N 1.359 1.011 0 C-N-CA 124.665 1.186 . . . . 74.15 109.669 168.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 34.2 m80 -133.81 103.08 5.69 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 123.683 0.793 . . . . 75.42 110.105 -176.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 47.6 t60 . . . . . 0 CA--C 1.556 1.173 0 N-CA-C 107.881 -1.155 . . . . 72.24 107.881 176.356 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 119.065 -0.493 . . . . 70.33 109.842 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -56.49 121.82 10.71 Favored 'Trans proline' 0 C--N 1.377 2.05 0 C-N-CA 121.897 1.731 . . . . 62.51 110.864 168.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.55 ' O ' ' HG3' ' A' ' 7' ' ' GLU . 22.3 t -60.84 -23.85 65.44 Favored 'General case' 0 C--O 1.212 -0.87 0 C-N-CA 123.229 0.612 . . . . 64.14 110.61 178.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.2 tp10 -51.33 -47.22 62.77 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.134 1.374 . . . . 75.41 111.651 173.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -75.2 -39.86 59.79 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.201 0.6 . . . . 75.51 110.403 177.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.445 ' HA ' ' HD2' ' A' ' 9' ' ' ARG . 11.7 tp10 -66.47 -22.17 66.2 Favored 'General case' 0 C--O 1.245 0.816 0 CA-C-N 115.108 -0.951 . . . . 74.23 111.312 -176.277 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.55 ' HG3' ' O ' ' A' ' 3' ' ' SER . 72.9 mt-10 -50.5 -66.74 0.34 Allowed 'General case' 0 C--N 1.364 1.205 0 O-C-N 124.022 0.826 . . . . 70.35 109.981 173.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.461 ' HD2' ' HB2' ' A' ' 7' ' ' GLU . 10.6 mptt -66.0 -27.82 68.42 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 123.908 0.755 . . . . 74.43 111.295 -169.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.445 ' HD2' ' HA ' ' A' ' 6' ' ' GLU . 90.5 mtt180 -59.71 -40.14 86.94 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.091 0.556 . . . . 75.34 110.398 176.295 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -77.91 -51.38 10.51 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 115.107 -0.951 . . . . 74.53 110.751 173.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.519 HG22 ' O ' ' A' ' 7' ' ' GLU . 52.0 t -66.04 -44.77 91.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 123.653 0.781 . . . . 64.5 112.486 -164.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 29.1 mtmm -66.05 -31.97 73.16 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 123.165 0.29 . . . . 75.13 110.394 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.406 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 8.4 tt0 -70.76 -43.82 68.01 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 124.107 0.879 . . . . 74.3 110.185 178.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.474 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 87.8 t -65.08 -39.83 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 N-CA-C 109.557 -0.534 . . . . 65.22 109.557 176.023 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.91 -44.2 81.37 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.198 0.999 . . . . 71.51 111.598 -175.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -67.85 -34.82 77.45 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 123.793 0.683 . . . . 75.44 110.164 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.47 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 22.4 mm-40 -61.01 -46.02 92.46 Favored 'General case' 0 C--N 1.356 0.848 0 O-C-N 123.633 0.583 . . . . 71.45 111.077 177.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.533 ' HG3' HG22 ' A' ' 68' ' ' VAL . 71.5 mmtt -67.22 -30.66 70.65 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.669 0.606 . . . . 75.45 111.09 -178.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.555 ' HB3' HD12 ' A' ' 46' ' ' LEU . 41.7 mt -70.15 -36.26 74.62 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.396 0.678 . . . . 64.24 111.442 174.29 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.3 mt -76.06 -22.89 55.15 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 123.764 0.826 . . . . 72.13 110.57 176.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 7.4 mm-40 -69.15 -36.94 77.97 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.261 0.624 . . . . 75.14 110.147 171.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -76.16 -42.06 47.86 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.21 0.604 . . . . 73.12 110.944 176.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.4 t -148.85 96.71 3.75 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 123.062 0.545 . . . . 73.22 110.368 -174.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -82.55 -1.98 10.83 Favored 'Trans proline' 0 C--N 1.372 1.805 0 C-N-CA 123.228 2.619 . . . . 71.4 112.434 172.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -83.41 -3.88 57.97 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.671 1.188 . . . . 72.33 111.676 178.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 34.4 p -127.09 142.56 51.49 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.382 0.673 . . . . 74.42 111.979 -168.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -77.85 136.43 38.07 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 123.818 0.699 . . . . 74.34 109.587 169.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 60.3 t -112.61 134.99 53.43 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 C-N-CA 123.973 0.909 . . . . 74.03 108.938 177.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -128.95 149.6 50.73 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.826 0.851 . . . . 70.11 109.396 176.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 73.8 t -77.05 110.35 12.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 N-CA-C 109.96 -0.385 . . . . 73.54 109.96 176.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -81.44 -59.57 2.58 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.656 0.782 . . . . 64.14 110.09 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.412 ' HB2' ' HB2' ' A' ' 43' ' ' GLU . 17.6 mmm180 -148.82 167.26 26.12 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.885 1.274 . . . . 71.23 108.981 -176.276 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 59.2 t -135.45 139.76 46.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 N-CA-C 108.704 -0.85 . . . . 72.21 108.704 171.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.404 ' O ' ' HA ' ' A' ' 40' ' ' ILE . 8.6 tp-100 -125.6 108.25 11.39 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 109.112 -0.699 . . . . 75.04 109.112 178.579 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -96.43 113.51 25.1 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 107.972 -1.122 . . . . 74.04 107.972 176.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 92.4 mm-40 -131.96 99.05 4.61 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.879 -0.786 . . . . 74.51 108.879 176.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 63.06 -102.53 0.53 Allowed Glycine 0 C--N 1.348 1.238 0 O-C-N 124.386 1.054 . . . . 72.3 112.908 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.462 HD21 ' HB3' ' A' ' 61' ' ' ARG . 18.1 m120 -97.15 -39.76 9.13 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.571 0.748 . . . . 75.14 109.838 174.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.452 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 11.5 m -80.69 96.42 6.9 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 123.296 0.638 . . . . 73.35 110.803 -172.061 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.404 ' HA ' ' O ' ' A' ' 34' ' ' GLN . 28.8 mt -87.54 107.32 17.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 115.779 -0.646 . . . . 72.44 109.357 168.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 31.6 mtm180 -87.82 96.07 10.33 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 108.01 -1.107 . . . . 73.52 108.01 174.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 48.6 t -82.59 121.17 35.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 N-CA-C 109.034 -0.728 . . . . 74.41 109.034 177.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.412 ' HB2' ' HB2' ' A' ' 32' ' ' ARG . 37.6 mt-10 -89.45 118.11 28.86 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.416 -0.811 . . . . 75.54 109.095 176.116 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.8 mp -122.99 164.04 19.29 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 108.823 -0.806 . . . . 74.12 108.823 176.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -125.56 111.82 15.48 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.633 0.773 . . . . 71.02 108.916 -169.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.555 HD12 ' HB3' ' A' ' 19' ' ' LEU . 8.5 tt -120.41 137.68 54.18 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.173 1.389 . . . . 70.23 108.361 -171.733 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 14.5 mtm180 -101.18 97.83 8.31 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 109.476 -0.565 . . . . 74.22 109.476 -178.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 8.0 m -82.35 105.25 13.27 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.2 0.6 . . . . 75.54 110.054 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 50.0 m-20 59.07 34.37 23.39 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.527 1.131 . . . . 73.01 111.783 177.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 96.73 -17.07 59.92 Favored Glycine 0 C--N 1.349 1.274 0 CA-C-N 115.865 -0.607 . . . . 75.23 113.488 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -85.79 121.07 27.92 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 117.511 0.655 . . . . 71.54 109.626 177.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -86.78 98.43 11.16 Favored 'General case' 0 C--O 1.241 0.629 0 N-CA-C 108.983 -0.747 . . . . 73.22 108.983 -176.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -108.59 134.61 51.11 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.907 0.883 . . . . 72.13 110.399 -175.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -88.43 120.87 30.21 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.633 -0.712 . . . . 74.54 110.525 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.507 ' CE2' ' HB3' ' A' ' 46' ' ' LEU . 19.1 m-85 -104.71 157.8 16.94 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.02 0.928 . . . . 65.31 109.801 177.496 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 85.3 m -134.23 103.04 5.59 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 107.984 -1.117 . . . . 74.11 107.984 173.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.403 HG22 HG21 ' A' ' 71' ' ' ILE . 52.0 t -90.1 105.25 16.01 Favored 'Isoleucine or valine' 0 C--O 1.241 0.647 0 N-CA-C 107.56 -1.274 . . . . 75.33 107.56 -179.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -77.12 111.27 12.54 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 114.891 -1.049 . . . . 62.31 109.129 -179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 24.7 t -122.81 122.59 66.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 123.635 0.774 . . . . 51.01 109.39 -178.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.452 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 29.8 tt0 -105.85 145.57 31.05 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.114 0.965 . . . . 72.3 110.859 -176.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.462 ' HB3' HD21 ' A' ' 38' ' ' ASN . 14.5 tpp180 -75.42 121.25 22.02 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 109.782 -0.451 . . . . 75.1 109.782 171.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -117.39 101.8 8.7 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.503 -0.925 . . . . 73.42 108.503 167.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.75 -106.24 1.76 Allowed Glycine 0 C--N 1.348 1.239 0 CA-C-N 115.96 -0.564 . . . . 64.32 111.98 -178.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -108.98 -19.71 13.3 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.342 0.657 . . . . 64.32 110.296 177.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.2 p -93.76 173.88 7.46 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.465 0.65 . . . . 73.3 111.442 -178.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -116.08 150.55 37.15 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.479 1.111 . . . . 75.22 109.442 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.3 t -134.77 123.15 23.14 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 109.457 -0.571 . . . . 72.34 109.457 -179.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.533 HG22 ' HG3' ' A' ' 18' ' ' LYS . 95.5 t -74.93 103.67 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 N-CA-C 108.812 -0.81 . . . . 75.31 108.812 175.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.523 ' HZ3' ' HB3' ' A' ' 69' ' ' LYS . 3.5 mmmp? -64.4 -52.77 56.54 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 123.934 0.894 . . . . 74.03 110.196 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -163.62 152.61 14.17 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.464 -0.789 . . . . 70.23 109.895 178.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.523 HD13 ' HB3' ' A' ' 18' ' ' LYS . 70.5 mt -101.95 110.14 27.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 N-CA-C 108.029 -1.1 . . . . 74.51 108.029 170.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 17.4 m -91.65 142.8 27.23 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 108.542 -0.91 . . . . 75.02 108.542 178.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 27.9 ttp180 -118.31 144.33 45.93 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 107.536 -1.283 . . . . 73.23 107.536 168.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.4 t -58.28 144.79 40.01 Favored 'General case' 0 C--O 1.248 0.996 0 C-N-CA 122.943 0.497 . . . . 75.53 109.994 176.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 58.8 t -60.69 99.83 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 N-CA-C 108.621 -0.881 . . . . 70.04 108.621 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -139.55 7.36 3.06 Favored Glycine 0 CA--C 1.51 -0.232 0 CA-C-N 114.642 -1.163 . . . . 71.55 110.746 176.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 16.6 m -68.3 84.1 0.25 Allowed 'General case' 0 C--N 1.353 0.747 0 C-N-CA 124.264 1.026 . . . . 73.01 110.004 177.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.86 153.72 40.91 Favored 'General case' 0 C--O 1.244 0.802 0 CA-C-N 115.379 -0.828 . . . . 73.13 110.746 179.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -67.17 140.23 57.48 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.794 -0.639 . . . . 74.52 111.158 -175.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 45.5 p-80 -137.66 147.26 44.76 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-N 115.148 -0.933 . . . . 74.3 108.862 174.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 50.6 m80 -72.84 150.43 42.69 Favored 'General case' 0 C--O 1.242 0.704 0 C-N-CA 123.577 0.751 . . . . 74.1 111.747 -175.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 38.2 t60 -66.72 101.02 0.75 Allowed 'General case' 0 C--N 1.346 0.445 0 CA-C-N 115.135 -0.938 . . . . 73.33 108.818 171.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 78.6 m80 -58.31 143.26 45.4 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.837 0.855 . . . . 75.03 110.206 177.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 48.2 t-80 66.32 87.32 0.12 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.486 1.114 . . . . 70.01 108.931 -170.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 11.8 p80 . . . . . 0 C--O 1.253 1.289 0 C-N-CA 123.616 0.766 . . . . 61.12 110.021 -172.706 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.2 ttm . . . . . 0 N--CA 1.481 1.105 0 N-CA-C 109.042 -0.725 . . . . 73.24 109.042 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -80.92 82.6 2.42 Favored 'Trans proline' 0 C--N 1.373 1.852 0 C-N-CA 122.753 2.302 . . . . 72.02 112.164 178.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.507 ' HB3' ' HG3' ' A' ' 6' ' ' GLU . 38.6 t -66.43 137.28 56.73 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-N 115.843 -0.617 . . . . 75.4 109.764 177.078 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -68.4 -19.8 64.63 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 115.943 -0.572 . . . . 73.33 111.224 179.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -66.55 -36.74 83.4 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.886 0.874 . . . . 71.24 110.706 173.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.507 ' HG3' ' HB3' ' A' ' 3' ' ' SER . 45.2 mt-10 -59.41 -33.57 71.4 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.39 0.676 . . . . 74.35 110.348 177.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.473 ' O ' HG23 ' A' ' 11' ' ' VAL . 51.1 mm-40 -63.47 -40.93 98.42 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 123.899 0.749 . . . . 75.13 111.35 178.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.19 -41.65 98.55 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.247 0.619 . . . . 61.55 110.32 179.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -58.83 -44.79 90.97 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 124.026 0.93 . . . . 75.12 110.822 175.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.436 ' O ' HG22 ' A' ' 14' ' ' VAL . 68.5 mt-30 -62.96 -45.11 93.97 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 114.904 -1.044 . . . . 74.44 111.089 179.249 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.528 HG22 HD12 ' A' ' 40' ' ' ILE . 87.6 t -66.71 -43.51 90.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 123.621 0.769 . . . . 74.52 111.423 -176.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -61.45 -37.69 84.49 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 123.486 0.491 . . . . 75.54 110.442 176.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.507 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.5 tt0 -65.79 -49.14 69.38 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 124.119 0.887 . . . . 74.43 110.323 179.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.436 HG22 ' O ' ' A' ' 10' ' ' GLN . 89.0 t -58.12 -45.69 88.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 C-N-CA 123.068 0.547 . . . . 64.12 109.784 176.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.84 -42.29 97.63 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.175 0.99 . . . . 74.52 112.179 -175.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -73.72 -35.44 65.09 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 116.317 -0.401 . . . . 75.34 110.667 -176.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.507 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 25.3 mm-40 -65.87 -37.13 85.33 Favored 'General case' 0 C--N 1.353 0.732 0 O-C-N 123.422 0.451 . . . . 75.33 110.369 176.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.537 ' HB3' HD13 ' A' ' 71' ' ' ILE . 65.9 mmtt -63.26 -37.1 85.94 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.347 0.659 . . . . 74.53 110.897 176.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 23.8 mt -72.49 -30.65 64.71 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 115.85 -0.614 . . . . 71.12 111.414 176.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 75.5 mt -76.19 -19.68 58.2 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.333 0.653 . . . . 75.54 111.045 177.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -77.0 -21.12 55.17 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.018 0.527 . . . . 71.22 110.714 170.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 -88.64 -38.12 15.06 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.165 0.586 . . . . 73.25 110.226 175.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.8 t -157.31 102.51 1.87 Allowed Pre-proline 0 CA--C 1.552 1.048 0 C-N-CA 124.208 1.003 . . . . 42.32 109.215 -176.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -77.04 -27.61 6.69 Favored 'Trans proline' 0 C--N 1.373 1.824 0 C-N-CA 122.796 2.331 . . . . 74.24 112.851 -176.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -74.46 -27.93 60.8 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.766 0.826 . . . . 74.33 111.18 -173.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 54.5 m -80.47 130.04 34.9 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 123.299 0.64 . . . . 74.13 111.373 -174.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -73.67 123.49 24.15 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 123.509 0.724 . . . . 75.14 109.697 175.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.529 HG23 HD13 ' A' ' 46' ' ' LEU . 40.8 t -99.68 113.29 34.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 123.315 0.646 . . . . 74.34 109.617 -177.074 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -94.61 151.72 19.09 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.945 -0.761 . . . . 75.14 108.945 174.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 p -87.09 105.75 15.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 N-CA-C 108.936 -0.765 . . . . 72.03 108.936 171.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -77.21 -42.7 36.41 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.249 0.62 . . . . 72.41 110.435 -177.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 17.5 tpp85 -170.01 155.55 5.63 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.976 0.91 . . . . 74.43 109.452 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 25.2 t -117.21 117.19 54.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.354 -0.98 . . . . 73.43 108.354 171.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -104.55 145.59 30.09 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 109.423 -0.584 . . . . 70.14 109.423 174.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.548 ' HG2' HG12 ' A' ' 40' ' ' ILE . 13.2 tmtt? -136.53 117.25 13.99 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 107.166 -1.42 . . . . 74.13 107.166 -177.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -133.25 96.3 3.71 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.082 0.953 . . . . 72.45 108.733 -175.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.47 -92.76 0.28 Allowed Glycine 0 C--N 1.348 1.248 0 O-C-N 123.555 0.535 . . . . 72.53 112.215 -177.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.428 ' HB3' ' HB3' ' A' ' 61' ' ' ARG . 19.3 m120 -114.18 -25.23 8.57 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.971 0.909 . . . . 75.23 110.741 175.079 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.561 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 19.9 m -81.79 103.8 11.73 Favored 'General case' 0 C--O 1.24 0.587 0 C-N-CA 123.158 0.583 . . . . 75.11 111.252 -176.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.548 HG12 ' HG2' ' A' ' 35' ' ' LYS . 39.6 mt -86.76 107.12 16.54 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 N-CA-C 109.063 -0.717 . . . . 72.51 109.063 168.4 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.433 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 95.0 mtt180 -92.29 96.72 10.45 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 108.406 -0.961 . . . . 74.23 108.406 176.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.401 HG13 ' HG ' ' A' ' 44' ' ' LEU . 39.2 t -80.25 120.7 32.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 N-CA-C 108.421 -0.955 . . . . 73.23 108.421 176.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -84.89 115.49 22.8 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 107.482 -1.303 . . . . 74.53 107.482 170.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.401 ' HG ' HG13 ' A' ' 42' ' ' VAL . 1.9 mp -117.82 142.87 46.82 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 109.594 -0.521 . . . . 75.33 109.594 178.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -107.2 104.82 14.55 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.916 0.886 . . . . 72.02 108.787 -175.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.529 HD13 HG23 ' A' ' 28' ' ' VAL . 8.3 tt -117.2 135.46 53.77 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.323 1.049 . . . . 74.35 108.747 -175.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 64.6 mtm180 -103.0 97.74 7.8 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 109.306 -0.627 . . . . 73.33 109.306 -178.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 89.1 m -76.35 96.44 4.0 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.655 0.782 . . . . 74.32 109.761 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 60.85 27.17 17.0 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.245 1.018 . . . . 61.03 111.328 -178.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 99.72 -8.09 59.67 Favored Glycine 0 C--N 1.354 1.537 0 CA-C-N 115.58 -0.736 . . . . 70.43 113.74 -179.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.505 ' HA ' ' HE2' ' A' ' 51' ' ' LYS . 11.0 mmpt? -83.75 124.23 30.67 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 117.402 0.601 . . . . 74.31 109.468 174.095 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -81.47 109.49 15.99 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.079 0.551 . . . . 75.55 110.208 -175.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -127.64 118.78 24.51 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.775 0.83 . . . . 72.2 109.815 -177.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -80.32 147.07 31.27 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.812 -0.81 . . . . 62.1 108.812 171.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 -129.88 120.57 25.13 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.762 0.825 . . . . 74.15 108.829 179.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 90.8 m -85.44 100.64 12.01 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 108.404 -0.962 . . . . 71.21 108.404 170.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.463 HG22 HG23 ' A' ' 71' ' ' ILE . 43.4 t -97.52 102.87 13.99 Favored 'Isoleucine or valine' 0 C--O 1.243 0.728 0 N-CA-C 107.591 -1.263 . . . . 72.25 107.591 175.075 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.433 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 31.7 mt-10 -80.57 101.52 9.21 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 114.319 -1.31 . . . . 73.24 108.483 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.508 ' HB ' HG12 ' A' ' 11' ' ' VAL . 21.2 t -109.39 109.45 28.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 N-CA-C 107.84 -1.17 . . . . 73.43 107.84 177.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.561 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 45.8 tt0 -101.9 146.34 27.97 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.729 0.811 . . . . 75.41 109.767 -175.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.428 ' HB3' ' HB3' ' A' ' 38' ' ' ASN . 8.6 tpt180 -80.49 111.24 16.72 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.659 0.784 . . . . 75.03 110.595 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 -106.11 93.5 4.65 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 108.398 -0.964 . . . . 62.52 108.398 174.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.08 -100.69 0.73 Allowed Glycine 0 C--N 1.344 1.011 0 CA-C-N 115.549 -0.75 . . . . 44.45 112.045 -177.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -105.65 -26.08 11.99 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.23 1.012 . . . . 73.41 110.831 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.2 p -93.61 160.65 14.68 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.579 0.752 . . . . 73.13 111.686 -174.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -108.16 109.81 21.3 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.625 1.17 . . . . 74.41 109.821 176.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 9.8 t -103.83 127.67 51.31 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.67 0.788 . . . . 72.42 110.712 -178.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.478 HG23 HG22 ' A' ' 59' ' ' VAL . 63.6 t -77.51 110.14 12.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 N-CA-C 109.617 -0.512 . . . . 73.32 109.617 176.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -69.05 -49.52 56.81 Favored 'General case' 0 C--O 1.24 0.58 0 C-N-CA 123.363 0.665 . . . . 74.11 110.534 178.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -166.69 143.1 4.66 Favored 'General case' 0 C--N 1.348 0.501 0 CA-C-N 116.291 -0.413 . . . . 73.2 111.49 177.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.537 HD13 ' HB3' ' A' ' 18' ' ' LYS . 56.8 mt -97.84 106.95 19.37 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 N-CA-C 107.739 -1.208 . . . . 73.13 107.739 166.442 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 37.4 m -102.51 119.73 39.31 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.307 0.643 . . . . 75.41 109.48 178.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 28.4 ttp180 -75.93 148.08 38.47 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 109.331 -0.618 . . . . 74.43 109.331 176.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.4 t -54.2 137.15 41.52 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 124.394 1.078 . . . . 73.23 112.616 -173.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 45.9 t -69.27 103.51 0.84 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.606 0 CA-C-N 115.382 -0.826 . . . . 63.13 108.946 176.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 163.72 -37.84 0.32 Allowed Glycine 0 C--O 1.239 0.438 0 N-CA-C 109.47 -1.452 . . . . 75.22 109.47 -172.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 20.9 t -87.92 178.01 6.81 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 123.689 0.796 . . . . 73.15 109.913 172.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.3 tt -136.24 117.67 14.74 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 108.141 -1.059 . . . . 70.35 108.141 -177.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -79.94 97.67 6.84 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 107.995 -1.113 . . . . 42.13 107.995 172.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 29.5 p80 -64.79 154.13 37.89 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.8 0.44 . . . . 74.01 111.765 -170.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 72.2 m-70 -69.82 153.59 43.12 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.519 0.728 . . . . 72.43 111.389 -176.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -96.55 119.11 34.44 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.088 -0.96 . . . . 62.33 109.003 -175.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 41.4 t60 -70.09 108.02 3.91 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 108.587 -0.894 . . . . 75.41 108.587 174.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 14.3 p80 -67.5 125.84 27.42 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 122.672 0.389 . . . . 72.02 110.211 -175.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 21.7 p80 . . . . . 0 C--O 1.251 1.146 0 CA-C-N 116.038 -0.528 . . . . 73.04 109.848 174.256 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.1 mmt . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 119.353 -0.356 . . . . 71.53 110.452 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -56.42 -39.04 93.97 Favored 'Trans proline' 0 C--N 1.383 2.361 0 C-N-CA 123.238 2.626 . . . . 60.21 112.792 175.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 29.8 m -83.84 104.73 14.17 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.451 -0.795 . . . . 70.11 109.344 177.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -78.65 -36.54 43.77 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.083 0.953 . . . . 71.24 110.73 -174.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -67.21 -35.52 79.78 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-O 120.948 0.404 . . . . 73.35 110.221 178.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -51.35 -42.0 60.99 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.04 1.336 . . . . 65.14 111.769 -178.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.468 ' O ' HG22 ' A' ' 11' ' ' VAL . 9.8 mm-40 -57.42 -43.32 83.7 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.987 0.915 . . . . 72.43 111.914 -175.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.442 ' HD2' ' N ' ' A' ' 8' ' ' LYS . 10.5 mptt -68.76 -48.21 64.3 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 108.872 -0.788 . . . . 74.12 108.872 -179.276 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -59.13 -34.53 72.16 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.697 1.199 . . . . 75.45 112.117 -177.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -70.89 -53.62 14.45 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.633 0.773 . . . . 72.22 110.817 178.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.624 HG12 ' HB ' ' A' ' 59' ' ' VAL . 59.8 t -63.36 -44.59 99.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 123.27 0.628 . . . . 75.31 111.639 -172.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.571 ' HD2' HG13 ' A' ' 30' ' ' VAL . 48.2 mtmt -66.02 -33.8 76.63 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.396 0.679 . . . . 74.31 110.592 -179.376 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.503 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.4 tt0 -66.45 -59.11 3.97 Favored 'General case' 0 C--N 1.355 0.811 0 O-C-N 123.96 0.788 . . . . 70.01 109.699 176.215 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.4 t -52.49 -44.77 45.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 C-N-CA 124.435 1.094 . . . . 71.23 111.129 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.69 -42.05 98.41 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.282 1.033 . . . . 64.23 111.646 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.3 tttm -65.54 -43.72 89.09 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.441 1.096 . . . . 74.24 110.719 175.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 15.7 mm-40 -61.24 -41.91 97.71 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 123.843 0.715 . . . . 74.15 110.573 -177.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -64.56 -41.52 96.26 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 124.196 0.935 . . . . 75.11 110.966 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.441 HD23 ' NE2' ' A' ' 22' ' ' GLN . 77.3 mt -70.17 -27.61 64.66 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.0 0.52 . . . . 75.01 111.733 177.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 90.6 mt -73.63 -33.89 64.75 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.436 0.694 . . . . 74.14 110.36 174.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -71.1 -36.68 72.26 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.475 0.71 . . . . 74.13 110.783 177.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.441 ' NE2' HD23 ' A' ' 19' ' ' LEU . 24.2 mt-30 -76.43 -35.55 58.45 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.558 0.743 . . . . 74.42 111.457 178.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 29.8 t -148.24 93.74 4.35 Favored Pre-proline 0 CA--C 1.55 0.971 0 N-CA-C 109.433 -0.58 . . . . 70.23 109.433 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -76.0 -4.07 14.67 Favored 'Trans proline' 0 C--N 1.378 2.119 0 C-N-CA 122.792 2.328 . . . . 71.42 112.867 173.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.438 ' N ' HD21 ' A' ' 25' ' ' ASN . 0.7 OUTLIER -83.07 -19.46 36.8 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.055 0.942 . . . . 73.54 110.059 173.627 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.44 ' HA ' ' HB ' ' A' ' 48' ' ' THR . 39.4 t -86.45 141.02 29.43 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 123.386 0.675 . . . . 75.52 112.325 -173.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -89.87 108.93 20.0 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 107.3 -1.37 . . . . 74.13 107.3 164.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 88.6 t -98.48 113.37 32.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 C-N-CA 123.82 0.848 . . . . 74.34 109.206 -176.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 61.3 tp60 -117.87 124.21 47.75 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.578 0.751 . . . . 75.43 109.811 -178.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.571 HG13 ' HD2' ' A' ' 12' ' ' LYS . 55.8 t -62.8 108.1 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 N-CA-C 109.309 -0.626 . . . . 75.43 109.309 174.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 24.1 tpt85 -88.43 -36.27 16.6 Favored 'General case' 0 CA--C 1.549 0.915 0 CA-C-N 115.28 -0.873 . . . . 72.24 111.607 -175.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -170.0 165.49 9.44 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.328 0.651 . . . . 71.41 109.336 -177.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.491 HG23 ' HD3' ' A' ' 12' ' ' LYS . 97.5 t -141.69 123.44 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 124.012 0.925 . . . . 72.51 109.594 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -101.31 109.99 21.92 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.209 0.604 . . . . 72.41 109.537 170.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.513 ' HG2' HG12 ' A' ' 40' ' ' ILE . 6.2 tmtm? -99.09 108.53 21.19 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 108.303 -0.999 . . . . 72.43 108.303 179.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -126.99 99.4 5.7 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.804 0.842 . . . . 73.41 110.413 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.04 -120.78 17.06 Favored Glycine 0 C--N 1.356 1.654 0 CA-C-N 115.322 -0.854 . . . . 73.23 112.641 176.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -77.05 -35.03 57.11 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.521 0.728 . . . . 74.31 110.654 178.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.474 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 89.5 m -87.95 126.39 35.03 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-O 121.319 0.58 . . . . 65.42 110.216 -175.502 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.513 HG12 ' HG2' ' A' ' 35' ' ' LYS . 33.3 mt -115.27 107.94 24.07 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 N-CA-C 107.836 -1.172 . . . . 75.41 107.836 173.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.57 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 94.4 mtt180 -83.31 131.62 35.07 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 123.905 0.882 . . . . 75.14 108.674 173.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.47 HG11 HG22 ' A' ' 33' ' ' VAL . 35.5 t -118.81 116.83 52.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 108.634 -0.876 . . . . 74.11 108.634 175.247 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.607 ' HG3' ' HG1' ' A' ' 56' ' ' THR . 4.6 mp0 -83.68 103.68 13.19 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 107.869 -1.159 . . . . 75.21 107.869 172.291 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.438 ' HG ' HG12 ' A' ' 42' ' ' VAL . 0.6 OUTLIER -109.6 166.85 10.58 Favored 'General case' 0 N--CA 1.484 1.235 0 N-CA-C 107.963 -1.125 . . . . 71.13 107.963 173.458 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -122.12 125.83 47.03 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.816 0.341 . . . . 73.24 110.255 -173.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.0 tt -96.85 115.57 27.66 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.911 1.284 . . . . 70.51 107.692 -177.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -120.79 105.92 11.19 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.962 0.905 . . . . 74.02 110.222 -177.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.44 ' HB ' ' HA ' ' A' ' 26' ' ' SER . 12.7 t -158.72 135.69 9.73 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.146 0.579 . . . . 74.21 110.057 176.19 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 60.95 22.83 12.98 Favored 'General case' 0 N--CA 1.499 2.017 0 C-N-CA 124.227 1.011 . . . . 65.54 112.534 176.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 85.91 2.36 86.37 Favored Glycine 0 C--N 1.354 1.58 0 CA-C-O 119.956 -0.358 . . . . 41.31 113.396 -176.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.489 ' HZ1' ' HB3' ' A' ' 51' ' ' LYS . 2.1 mmmp? -84.49 127.11 33.85 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.882 0.873 . . . . 74.42 108.75 174.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -136.04 99.15 4.06 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 107.579 -1.267 . . . . 74.44 107.579 -178.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -138.32 130.97 29.32 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.862 0.865 . . . . 63.13 109.78 -178.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 35.6 m-80 -83.4 127.23 33.51 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.352 0.661 . . . . 54.31 110.61 178.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -106.5 119.98 40.72 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.985 0.914 . . . . 72.44 109.351 176.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.607 ' HG1' ' HG3' ' A' ' 43' ' ' GLU . 80.5 m -86.7 101.7 13.53 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 124.762 1.225 . . . . 72.1 108.817 172.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.528 HG23 HG21 ' A' ' 71' ' ' ILE . 45.5 t -93.31 105.45 16.84 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 N-CA-C 108.437 -0.949 . . . . 73.15 108.437 179.124 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.57 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 33.6 mt-10 -77.94 112.15 14.54 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.796 0.839 . . . . 61.55 108.774 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.624 ' HB ' HG12 ' A' ' 11' ' ' VAL . 17.6 t -124.66 115.31 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 N-CA-C 108.573 -0.899 . . . . 72.2 108.573 177.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.474 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 29.4 tt0 -100.7 148.3 25.03 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.069 0.948 . . . . 74.34 110.233 -176.516 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.12 114.13 19.76 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 109.262 -0.644 . . . . 73.12 109.262 176.161 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 -119.81 86.61 2.59 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 124.275 1.03 . . . . 72.01 108.276 177.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 68.55 -132.37 27.17 Favored Glycine 0 C--N 1.346 1.101 0 CA-C-N 115.692 -0.685 . . . . 61.14 111.631 -175.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -80.59 -2.17 45.25 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.714 0.806 . . . . 55.13 111.721 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 73.8 p -114.56 150.96 34.16 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.084 0.554 . . . . 74.45 110.563 -176.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 96.3 m95 -98.32 119.18 36.55 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.056 0.942 . . . . 75.42 108.827 168.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 10.0 t -103.13 121.29 42.32 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.442 0.697 . . . . 75.32 109.875 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 51.2 t -76.29 106.97 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 108.494 -0.928 . . . . 75.22 108.494 176.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.454 ' HD3' ' HB3' ' A' ' 60' ' ' GLU . 1.5 mmmp? -65.02 -57.13 9.49 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 115.589 -0.732 . . . . 65.11 110.128 -179.352 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 63.1 ttt180 -167.26 136.25 2.71 Favored 'General case' 0 C--N 1.352 0.676 0 CA-C-N 116.008 -0.542 . . . . 75.24 110.597 178.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.528 HG21 HG23 ' A' ' 57' ' ' VAL . 71.9 mt -87.35 105.91 15.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 107.653 -1.24 . . . . 73.41 107.653 171.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 19.6 m -107.07 115.5 30.29 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.341 0.656 . . . . 75.54 109.506 -174.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -68.84 149.9 48.42 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.015 0.526 . . . . 71.52 109.753 172.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.8 t -59.37 153.98 17.8 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.791 0.837 . . . . 73.51 110.202 167.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 3.5 p -65.48 100.4 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.173 0 CA-C-O 121.714 0.769 . . . . 53.23 109.178 174.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -137.21 -21.01 0.55 Allowed Glycine 0 C--N 1.344 0.981 0 CA-C-N 114.87 -1.059 . . . . 51.42 111.961 -178.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.9 t -69.45 129.66 40.33 Favored 'General case' 0 C--N 1.349 0.554 0 N-CA-C 109.536 -0.542 . . . . 63.24 109.536 176.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 68.5 tp -60.28 -38.56 83.97 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.724 0.81 . . . . 55.13 110.995 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -77.44 4.97 9.73 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.515 0.726 . . . . 63.35 112.362 -174.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -45.7 107.41 0.1 Allowed 'General case' 0 C--N 1.366 1.32 0 C-N-CA 124.097 0.959 . . . . 74.1 111.156 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 32.3 m-70 -65.51 142.91 57.97 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-N 114.745 -1.116 . . . . 72.54 109.266 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 31.2 m-70 -63.23 95.76 0.09 Allowed 'General case' 0 N--CA 1.476 0.855 0 O-C-N 123.856 0.722 . . . . 74.34 110.058 -174.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 77.8 t60 -167.05 125.28 1.32 Allowed 'General case' 0 C--O 1.24 0.601 0 C-N-CA 125.213 1.405 . . . . 72.15 107.811 -174.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -93.81 143.59 26.19 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 123.701 0.801 . . . . 73.22 109.061 176.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 42.1 t-80 . . . . . 0 C--O 1.254 1.33 0 N-CA-C 108.8 -0.815 . . . . 73.22 108.8 173.897 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.3 mtm . . . . . 0 N--CA 1.484 1.236 0 N-CA-C 108.618 -0.882 . . . . 74.34 108.618 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -57.6 -47.5 21.23 Favored 'Trans proline' 0 C--N 1.387 2.575 0 C-N-CA 123.63 2.887 . . . . 74.54 112.914 -176.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.4 m -85.12 102.37 13.21 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 108.466 -0.939 . . . . 62.41 108.466 175.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.14 -19.67 61.74 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 122.766 0.426 . . . . 71.13 110.933 175.39 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -54.58 -26.34 31.81 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 124.324 1.049 . . . . 53.1 112.641 167.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -57.58 -37.78 73.76 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 123.75 0.656 . . . . 72.13 110.802 174.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -64.22 -40.96 97.14 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 116.196 -0.456 . . . . 74.33 111.097 177.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.543 ' HG3' HG12 ' A' ' 33' ' ' VAL . 1.0 OUTLIER -62.49 -42.41 99.48 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 123.713 0.633 . . . . 73.53 110.016 177.755 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 41.8 ttt180 -56.77 -44.31 81.7 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.776 0.831 . . . . 74.33 111.131 177.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.504 ' O ' HG21 ' A' ' 14' ' ' VAL . 46.4 mt-30 -68.92 -45.97 69.49 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 114.929 -1.032 . . . . 72.12 110.945 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.595 HG21 HD12 ' A' ' 40' ' ' ILE . 55.1 t -70.84 -43.47 76.96 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 124.065 0.946 . . . . 74.34 112.243 -173.44 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -61.66 -36.05 79.72 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.171 0.588 . . . . 71.34 110.168 176.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.505 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 8.8 tt0 -64.22 -52.51 58.47 Favored 'General case' 0 C--N 1.354 0.764 0 O-C-N 124.088 0.867 . . . . 74.41 110.21 176.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.516 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 84.9 t -55.25 -44.43 75.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 123.137 0.575 . . . . 63.54 110.22 178.057 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.01 -47.91 75.79 Favored 'General case' 0 C--O 1.248 1.017 0 C-N-CA 124.664 1.186 . . . . 63.43 112.52 -176.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.402 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 14.8 ptmm? -68.1 -35.8 78.74 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 115.564 -0.744 . . . . 71.31 110.854 -175.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.505 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 38.9 mm-40 -62.5 -40.09 95.58 Favored 'General case' 0 C--N 1.353 0.727 0 O-C-N 123.772 0.67 . . . . 74.14 111.25 179.191 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.516 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 13.9 mmmm -64.45 -40.14 95.16 Favored 'General case' 0 CA--C 1.551 1.008 0 O-C-N 123.425 0.453 . . . . 74.1 110.85 178.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.489 HD22 ' NE2' ' A' ' 22' ' ' GLN . 81.9 mt -71.74 -29.47 64.56 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.98 0.912 . . . . 72.14 112.42 177.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 90.4 mt -73.63 -33.72 64.67 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.44 0.696 . . . . 74.33 110.256 175.592 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 50.0 mt-10 -66.63 -31.75 72.63 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.527 0.731 . . . . 73.23 110.776 173.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.489 ' NE2' HD22 ' A' ' 19' ' ' LEU . 48.7 mt-30 -77.56 -41.14 40.03 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.324 0.65 . . . . 65.1 111.587 176.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.0 t -144.7 88.78 6.92 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 122.788 0.435 . . . . 75.44 110.085 -176.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -75.46 -15.93 19.48 Favored 'Trans proline' 0 C--N 1.38 2.202 0 C-N-CA 123.393 2.729 . . . . 54.23 113.153 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -81.79 -13.86 57.16 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.39 0.676 . . . . 74.54 110.601 174.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 67.2 m -98.11 137.56 36.7 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.241 0.617 . . . . 65.52 110.521 176.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -84.72 117.17 23.65 Favored 'General case' 0 C--O 1.243 0.724 0 N-CA-C 107.808 -1.182 . . . . 74.44 107.808 166.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 66.5 t -99.21 112.43 31.39 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 O-C-N 123.501 0.501 . . . . 74.4 109.876 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -97.62 178.01 5.31 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.01 0.924 . . . . 74.32 108.897 174.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.2 p -105.99 125.52 61.52 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 N-CA-C 109.624 -0.51 . . . . 74.01 109.624 173.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.8 tpt180 -83.08 -59.03 2.61 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 109.281 -0.636 . . . . 55.41 109.281 178.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 21.5 mtm180 -146.14 166.31 26.54 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.466 1.106 . . . . 74.14 109.74 176.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.543 HG12 ' HG3' ' A' ' 8' ' ' LYS . 60.9 t -130.02 111.59 21.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 N-CA-C 107.401 -1.333 . . . . 65.4 107.401 176.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 24.8 tp60 -107.41 109.93 21.77 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 118.008 0.367 . . . . 72.01 110.185 -177.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -78.29 137.14 37.93 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 108.626 -0.879 . . . . 65.32 108.626 170.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -143.55 82.65 1.74 Allowed 'General case' 0 C--O 1.242 0.662 0 N-CA-C 108.593 -0.892 . . . . 70.33 108.593 -177.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.54 -79.11 0.82 Allowed Glycine 0 C--N 1.348 1.242 0 CA-C-N 115.443 -0.799 . . . . 64.4 112.565 -178.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -131.98 -18.38 2.67 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.108 0.963 . . . . 72.01 110.994 174.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.521 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 7.0 m -85.21 116.74 23.74 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 122.78 0.432 . . . . 75.1 109.889 177.605 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.595 HD12 HG21 ' A' ' 11' ' ' VAL . 32.4 mt -91.0 106.35 17.44 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 N-CA-C 108.988 -0.745 . . . . 61.33 108.988 169.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.418 ' HA ' ' HA ' ' A' ' 58' ' ' GLU . 35.2 mtp180 -89.06 94.46 9.95 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 108.11 -1.07 . . . . 74.22 108.11 175.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.403 HG21 HG12 ' A' ' 11' ' ' VAL . 39.3 t -85.97 114.52 25.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 N-CA-C 108.971 -0.752 . . . . 75.24 108.971 -179.241 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -84.12 109.63 17.86 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 108.024 -1.102 . . . . 73.24 108.024 172.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.5 mp -104.04 169.08 8.71 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 122.974 0.509 . . . . 73.21 110.286 177.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 57.8 tt0 -121.2 105.29 10.44 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.174 0.989 . . . . 75.44 109.151 -175.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.2 tt -101.09 110.79 22.85 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 108.102 -1.073 . . . . 74.24 108.102 -177.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 72.4 mtt180 -103.47 101.12 11.0 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.756 0.423 . . . . 74.53 110.806 -175.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 89.8 m -90.44 99.92 12.86 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.664 0.786 . . . . 75.43 110.84 176.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 18.9 m120 57.86 37.89 27.02 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 124.555 1.142 . . . . 71.12 112.027 175.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.15 -17.28 58.88 Favored Glycine 0 C--N 1.351 1.385 0 CA-C-N 115.344 -0.844 . . . . 75.35 113.314 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -81.26 123.88 28.86 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 117.602 0.701 . . . . 75.12 110.939 176.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -92.42 125.25 36.99 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.233 1.013 . . . . 72.1 110.057 -177.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -139.77 118.73 12.56 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 108.483 -0.932 . . . . 63.31 108.483 175.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -88.57 138.45 31.42 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 122.791 0.436 . . . . 73.31 111.355 -175.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -123.8 119.41 29.63 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.565 0.746 . . . . 75.43 109.209 178.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 28.2 m -86.42 100.13 12.13 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 109.391 -0.596 . . . . 74.1 109.391 175.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.456 HG21 HG22 ' A' ' 71' ' ' ILE . 45.9 t -93.31 104.21 15.49 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 N-CA-C 107.48 -1.304 . . . . 71.0 107.48 179.411 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.418 ' HA ' ' HA ' ' A' ' 41' ' ' ARG . 44.7 mt-10 -84.74 101.72 12.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.717 -1.129 . . . . 73.2 108.864 -176.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.51 ' HB ' HG11 ' A' ' 11' ' ' VAL . 21.6 t -106.65 111.26 34.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 124.067 0.947 . . . . 71.32 108.517 177.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.521 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 33.8 tt0 -100.97 150.13 23.2 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.523 0.729 . . . . 65.41 110.54 -175.165 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -68.16 106.28 2.36 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.355 0.662 . . . . 73.13 109.653 174.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 56.0 tp60 -92.83 85.96 5.35 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 108.43 -0.952 . . . . 73.35 108.43 173.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.02 -98.47 0.56 Allowed Glycine 0 C--N 1.348 1.244 0 N-CA-C 111.335 -0.706 . . . . 55.34 111.335 -174.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -101.53 -34.69 9.44 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.076 0.95 . . . . 75.11 109.98 176.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 65.0 p -84.87 175.97 8.78 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.827 0.851 . . . . 75.13 111.956 -174.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -114.05 139.39 49.33 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.565 1.146 . . . . 74.32 109.895 176.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 8.8 t -133.27 132.53 41.52 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.623 0.769 . . . . 73.44 110.109 -179.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.413 HG21 HG23 ' A' ' 59' ' ' VAL . 88.8 t -74.77 106.83 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 108.823 -0.806 . . . . 75.11 108.823 173.311 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.611 ' HB3' ' HZ1' ' A' ' 69' ' ' LYS . 2.9 mmmp? -63.46 -52.03 63.16 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.689 1.196 . . . . 74.22 109.857 175.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 19.1 tpt180 -175.67 144.43 0.65 Allowed 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.105 -0.952 . . . . 75.11 109.675 178.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.456 HG22 HG21 ' A' ' 57' ' ' VAL . 35.6 mt -88.38 110.56 21.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 N-CA-C 108.194 -1.039 . . . . 63.45 108.194 168.32 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 30.7 m -91.96 106.98 18.88 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.99 -0.745 . . . . 75.3 108.99 177.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 52.6 ttt180 -68.82 129.44 39.95 Favored 'General case' 0 C--O 1.244 0.816 0 N-CA-C 108.23 -1.026 . . . . 70.21 108.23 169.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 15.3 t -60.51 131.42 50.69 Favored 'General case' 0 C--O 1.246 0.889 0 O-C-N 123.774 0.671 . . . . 71.3 110.857 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 5.4 p -73.92 102.92 2.04 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.15 0 N-CA-C 108.917 -0.772 . . . . 74.05 108.917 175.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -145.57 3.31 1.16 Allowed Glycine 0 N--CA 1.479 1.515 0 CA-C-N 115.204 -0.907 . . . . 61.3 112.453 175.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 47.7 t -129.02 134.09 47.99 Favored 'General case' 0 C--O 1.244 0.771 0 C-N-CA 124.577 1.151 . . . . 64.22 108.369 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -77.19 104.13 7.51 Favored 'General case' 0 C--O 1.243 0.726 0 N-CA-C 108.408 -0.96 . . . . 75.32 108.408 178.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -69.61 90.63 0.57 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.952 0.901 . . . . 72.43 110.142 -177.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 -54.2 112.08 0.9 Allowed 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 113.985 -1.462 . . . . 75.55 111.215 178.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 9.7 p80 -126.34 134.69 51.02 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.707 0.803 . . . . 74.4 109.657 -175.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 11.0 p80 -144.89 162.35 37.07 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 122.939 0.495 . . . . 64.52 110.709 -173.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 61.7 m-70 -100.5 173.23 6.66 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.061 0.944 . . . . 74.34 108.602 171.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -87.42 -96.33 0.09 Allowed 'General case' 0 CA--C 1.554 1.124 0 CA-C-O 118.246 -0.883 . . . . 73.5 110.006 175.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 20.8 m80 . . . . . 0 N--CA 1.494 1.762 0 N-CA-C 108.641 -0.874 . . . . 73.01 108.641 174.331 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.481 1.088 0 CA-C-O 119.03 -0.509 . . . . 72.21 109.93 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.83 90.8 0.04 OUTLIER 'Trans proline' 0 C--N 1.382 2.319 0 C-N-CA 123.047 2.498 . . . . 75.53 112.431 171.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.44 ' O ' ' HG3' ' A' ' 7' ' ' GLU . 35.1 p -126.36 -51.25 1.51 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.029 1.332 . . . . 61.13 109.542 -177.215 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.06 -36.69 77.89 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.045 1.338 . . . . 72.42 112.388 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -83.97 -34.72 24.33 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 122.64 0.376 . . . . 54.45 110.682 176.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -61.87 -29.41 70.17 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.681 0.792 . . . . 73.3 111.209 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' A' ' 3' ' ' SER . 52.0 mt-10 -48.11 -53.57 16.17 Favored 'General case' 0 C--N 1.363 1.179 0 C-N-CA 124.074 0.949 . . . . 63.45 110.127 173.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.515 ' HG3' HG11 ' A' ' 33' ' ' VAL . 0.4 OUTLIER -56.22 -45.09 80.06 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 124.905 1.378 . . . . 74.51 109.732 -175.898 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -62.89 -38.12 89.63 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.97 0.908 . . . . 75.02 111.356 -177.27 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -75.02 -44.58 47.17 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.698 0.799 . . . . 72.44 110.9 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.44 HG22 HD11 ' A' ' 40' ' ' ILE . 90.6 t -76.41 -32.76 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.179 0.992 . . . . 74.31 112.301 -169.166 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.5 ' HZ1' ' HB2' ' A' ' 12' ' ' LYS . 9.1 mtmp? -61.32 -37.92 85.0 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 109.685 -0.487 . . . . 74.45 109.685 173.009 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.526 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 7.8 tt0 -67.54 -52.08 43.16 Favored 'General case' 0 C--N 1.352 0.717 0 O-C-N 124.248 0.968 . . . . 71.34 110.123 176.025 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.445 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 72.2 t -54.97 -39.88 51.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 123.223 0.609 . . . . 73.14 110.62 179.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.434 ' HA ' HG13 ' A' ' 57' ' ' VAL . . . -66.62 -48.42 69.55 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 115.363 -0.835 . . . . 74.11 112.078 -178.79 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -71.34 -34.9 70.94 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 123.713 0.633 . . . . 72.23 111.769 -174.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 20.7 mm-40 -61.63 -43.4 98.92 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 123.404 0.44 . . . . 75.4 110.623 -179.303 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.559 ' HG3' HG22 ' A' ' 68' ' ' VAL . 2.2 mmmp? -64.18 -42.79 96.55 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 123.759 0.662 . . . . 73.42 110.011 178.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.491 ' HB3' HD12 ' A' ' 46' ' ' LEU . 40.5 mt -63.0 -34.89 78.52 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.76 0.824 . . . . 75.32 112.563 177.515 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 85.1 mt -77.21 -26.41 52.7 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.389 0.676 . . . . 74.21 111.62 -177.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 12.5 mm-40 -69.87 -36.62 75.63 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 109.909 -0.404 . . . . 74.4 109.909 171.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -77.28 -31.37 54.77 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.312 1.045 . . . . 71.02 111.462 178.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.9 m -146.28 83.15 8.61 Favored Pre-proline 0 CA--C 1.56 1.35 0 C-N-CA 123.705 0.802 . . . . 72.14 109.935 -174.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -75.71 -21.26 14.75 Favored 'Trans proline' 0 C--N 1.375 1.951 0 C-N-CA 123.138 2.558 . . . . 64.41 112.127 177.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -86.57 15.28 5.71 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.326 1.05 . . . . 63.41 111.18 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 46.9 t -120.2 152.78 37.21 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.476 0.711 . . . . 71.51 111.207 -176.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.89 108.96 20.73 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 107.73 -1.211 . . . . 75.02 107.73 174.339 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.3 t -97.46 116.83 40.92 Favored 'Isoleucine or valine' 0 C--O 1.239 0.552 0 C-N-CA 123.508 0.723 . . . . 71.01 110.061 -176.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -101.59 161.94 13.27 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.578 1.151 . . . . 74.23 108.345 171.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 59.2 t -87.48 113.85 25.48 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 N-CA-C 107.834 -1.173 . . . . 73.54 107.834 169.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -81.89 -45.27 15.7 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.397 0.679 . . . . 73.41 110.111 -176.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 29.8 tpt180 -167.66 157.01 10.01 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 124.03 0.932 . . . . 70.24 109.145 177.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.515 HG11 ' HG3' ' A' ' 8' ' ' LYS . 58.0 t -120.87 130.58 74.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 123.464 0.706 . . . . 75.24 109.374 176.256 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.616 ' HB3' HE21 ' A' ' 36' ' ' GLN . 84.2 mm-40 -119.62 112.18 19.0 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.728 0.811 . . . . 75.13 109.706 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.559 ' HG2' HG12 ' A' ' 40' ' ' ILE . 3.6 tmtp? -92.06 107.4 19.18 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 106.747 -1.575 . . . . 74.01 106.747 173.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.616 HE21 ' HB3' ' A' ' 34' ' ' GLN . 83.6 mm-40 -119.55 101.58 8.03 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 108.522 -0.918 . . . . 75.5 108.522 -174.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.19 -93.72 0.52 Allowed Glycine 0 C--N 1.348 1.242 0 O-C-N 123.585 0.553 . . . . 40.33 112.488 -176.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -135.55 5.86 3.2 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.343 1.057 . . . . 64.03 109.26 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 69.3 m -118.67 116.16 26.01 Favored 'General case' 0 C--O 1.241 0.628 0 C-N-CA 124.69 1.196 . . . . 74.13 109.621 -177.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.559 HG12 ' HG2' ' A' ' 35' ' ' LYS . 35.0 mt -88.8 108.14 18.59 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-O 121.037 0.446 . . . . 75.11 110.119 178.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -86.17 95.22 9.5 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.403 1.081 . . . . 74.23 108.172 174.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 25.9 t -85.46 122.92 38.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 N-CA-C 109.13 -0.692 . . . . 61.33 109.13 178.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -87.24 121.21 29.39 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 108.007 -1.109 . . . . 75.13 108.007 170.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.8 mp -120.08 151.2 39.39 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-O 121.122 0.486 . . . . 73.12 109.917 179.289 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.486 ' HG3' ' HG3' ' A' ' 52' ' ' LYS . 39.3 tt0 -106.31 102.5 11.9 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 107.77 -1.196 . . . . 55.24 107.77 -179.648 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.491 HD12 ' HB3' ' A' ' 19' ' ' LEU . 8.8 tt -102.0 112.16 24.7 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.146 -1.057 . . . . 73.5 108.146 -174.558 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -100.78 101.1 11.88 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.273 0.629 . . . . 72.32 110.181 -169.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 37.5 m -110.11 96.31 6.15 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 122.828 0.451 . . . . 71.31 110.314 179.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 51.8 m-20 60.14 39.12 19.86 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.699 1.2 . . . . 71.31 111.547 173.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.77 -6.52 60.53 Favored Glycine 0 C--N 1.347 1.192 0 CA-C-N 115.648 -0.705 . . . . 75.1 113.336 177.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -85.78 130.94 34.42 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.381 0.672 . . . . 75.42 110.315 177.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.486 ' HG3' ' HG3' ' A' ' 45' ' ' GLU . 39.8 ttmt -99.48 98.38 9.29 Favored 'General case' 0 C--O 1.245 0.838 0 N-CA-C 108.259 -1.015 . . . . 73.22 108.259 173.096 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -102.37 112.53 25.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.975 -1.011 . . . . 73.24 108.451 179.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.46 HD22 ' HG2' ' A' ' 52' ' ' LYS . 0.8 OUTLIER -92.0 115.2 27.86 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 109.058 -0.719 . . . . 73.32 109.058 -177.038 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -108.45 121.1 44.25 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.627 0.771 . . . . 63.31 109.359 179.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 35.0 m -90.93 100.83 13.62 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 108.265 -1.013 . . . . 75.43 108.265 169.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.444 HG11 HG12 ' A' ' 71' ' ' ILE . 47.3 t -93.66 103.41 14.66 Favored 'Isoleucine or valine' 0 C--O 1.241 0.656 0 N-CA-C 107.326 -1.361 . . . . 75.25 107.326 177.369 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -87.59 100.8 13.06 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.439 -0.8 . . . . 73.23 108.871 -176.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.439 HG21 HG21 ' A' ' 68' ' ' VAL . 25.5 t -104.45 116.1 47.62 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 124.113 0.965 . . . . 73.24 109.165 -177.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -100.78 143.53 30.83 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.246 1.018 . . . . 63.54 109.947 -175.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.7 tpp180 -71.36 134.19 46.52 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.163 0.585 . . . . 64.23 110.602 176.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -133.05 89.84 2.67 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 108.274 -1.01 . . . . 61.12 108.274 172.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 68.26 -111.26 3.89 Favored Glycine 0 C--N 1.35 1.323 0 CA-C-N 114.813 -1.085 . . . . 73.34 112.325 -177.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -92.26 -25.68 18.5 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.287 0.635 . . . . 74.11 111.089 178.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 22.9 p -99.12 175.76 5.79 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.917 0.887 . . . . 75.22 111.847 -175.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -123.57 158.52 31.22 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.522 1.129 . . . . 74.23 109.761 179.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 9.0 t -145.46 135.3 23.55 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.494 0.318 . . . . 72.2 110.725 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.559 HG22 ' HG3' ' A' ' 18' ' ' LYS . 91.3 t -77.86 115.47 19.89 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 N-CA-C 109.227 -0.657 . . . . 52.45 109.227 173.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -80.92 -41.89 22.24 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 123.24 0.616 . . . . 75.22 110.632 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -165.38 144.35 6.42 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 123.462 0.705 . . . . 73.35 110.261 175.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.444 HG12 HG11 ' A' ' 57' ' ' VAL . 41.8 mt -104.25 107.66 22.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 N-CA-C 108.027 -1.101 . . . . 73.24 108.027 168.322 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.0 m -107.76 108.39 19.58 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.204 0.602 . . . . 74.43 109.676 -178.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 -79.29 150.01 31.63 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 109.579 -0.526 . . . . 74.12 109.579 172.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.3 t -65.74 115.58 6.03 Favored 'General case' 0 CA--C 1.554 1.12 0 CA-C-N 115.656 -0.702 . . . . 73.11 109.951 172.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 5.3 p -88.77 103.52 13.95 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 CA-C-O 121.427 0.632 . . . . 73.22 109.828 -178.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -96.3 -33.25 6.32 Favored Glycine 0 C--N 1.348 1.213 0 N-CA-C 111.39 -0.684 . . . . 73.03 111.39 174.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 24.7 p -99.69 115.29 29.12 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.687 0.795 . . . . 60.21 110.198 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.2 pp -82.91 178.31 8.23 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-O 121.414 0.626 . . . . 75.43 111.04 174.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -136.0 -166.51 1.88 Allowed 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.109 0.964 . . . . 72.23 109.038 -179.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 82.2 m-70 -73.45 104.37 4.42 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 122.724 0.409 . . . . 71.41 110.338 -179.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 57.0 p-80 -87.65 124.79 33.91 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 107.916 -1.142 . . . . 75.34 107.916 169.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -76.45 -31.73 58.0 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.11 0.564 . . . . 75.35 111.056 -173.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -136.27 168.58 19.15 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.994 0.917 . . . . 73.24 110.638 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 30.0 m170 -92.43 42.24 1.1 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 124.215 1.006 . . . . 74.34 110.255 -178.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 29.3 m-70 . . . . . 0 C--O 1.249 1.029 0 C-N-CA 123.51 0.724 . . . . 71.31 109.05 -178.571 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.5 ptt? . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 109.69 -0.485 . . . . 72.22 109.69 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -63.2 -51.21 2.89 Favored 'Trans proline' 0 C--N 1.373 1.862 0 C-N-CA 122.029 1.819 . . . . 73.23 110.351 167.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 37.2 t -159.78 145.63 15.76 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 107.474 -1.306 . . . . 73.42 107.474 173.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.32 -32.22 72.2 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 123.027 0.531 . . . . 74.13 111.102 -174.292 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -76.02 -32.96 59.64 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.002 0.921 . . . . 74.25 110.487 178.082 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.426 ' HG3' HE21 ' A' ' 10' ' ' GLN . 13.2 tp10 -63.25 -32.29 73.66 Favored 'General case' 0 C--N 1.353 0.746 0 C-N-CA 124.111 0.964 . . . . 74.4 110.085 -179.68 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.544 ' O ' HG22 ' A' ' 11' ' ' VAL . 39.9 mm-40 -55.04 -45.91 75.26 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 124.258 0.974 . . . . 74.24 111.895 175.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -62.2 -36.57 82.33 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 122.898 0.479 . . . . 74.01 111.389 -178.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.413 ' HA ' ' HE3' ' A' ' 12' ' ' LYS . 43.5 mtp180 -63.73 -38.96 93.05 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 115.557 -0.747 . . . . 74.44 109.797 179.172 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.426 HE21 ' HG3' ' A' ' 6' ' ' GLU . 58.0 mt-30 -66.59 -40.93 89.13 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 114.753 -1.112 . . . . 73.12 110.875 176.342 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.544 HG22 ' O ' ' A' ' 7' ' ' GLU . 63.0 t -61.05 -44.78 98.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 123.434 0.694 . . . . 71.54 111.9 -175.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.567 ' HZ1' ' HB2' ' A' ' 12' ' ' LYS . 10.1 mtmp? -60.92 -32.69 72.17 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 123.732 0.645 . . . . 72.45 110.724 179.65 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.506 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.9 tt0 -71.68 -53.78 12.45 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 115.361 -0.836 . . . . 72.44 110.323 176.371 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.5 t -53.91 -36.27 30.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 C-N-CA 123.598 0.759 . . . . 74.14 110.759 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.448 ' HA ' HG13 ' A' ' 57' ' ' VAL . . . -66.85 -50.95 60.9 Favored 'General case' 0 C--O 1.247 0.924 0 CA-C-N 114.795 -1.093 . . . . 73.32 111.454 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.435 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 20.5 ptmt -69.46 -33.08 72.38 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 116.18 -0.464 . . . . 73.23 111.925 -175.133 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.506 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 19.3 mm-40 -61.86 -43.0 99.72 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 123.691 0.619 . . . . 74.01 110.122 -179.114 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.433 ' HG3' HG22 ' A' ' 68' ' ' VAL . 14.9 mmmm -73.88 -22.43 59.73 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 115.603 -0.726 . . . . 64.52 111.143 -178.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 57.9 mt -73.9 -36.22 64.73 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 122.852 0.461 . . . . 70.41 111.541 169.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 83.6 mt -66.12 -32.15 73.44 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.627 0.771 . . . . 64.51 110.77 178.445 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -57.19 -41.31 79.08 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.918 0.887 . . . . 74.14 110.962 174.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -80.75 -51.72 8.34 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.488 -0.778 . . . . 73.2 110.824 -177.003 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 27.1 t -131.11 89.4 42.14 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 123.277 0.631 . . . . 72.03 109.927 -175.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -80.06 -1.93 11.73 Favored 'Trans proline' 0 C--N 1.375 1.965 0 C-N-CA 122.989 2.459 . . . . 73.41 112.592 174.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -86.56 6.55 30.19 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.964 0.906 . . . . 75.31 111.832 -178.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 21.5 p -143.72 141.98 30.73 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.514 0.726 . . . . 71.11 110.644 -171.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -86.72 136.63 32.94 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 108.342 -0.985 . . . . 73.13 108.342 174.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.506 HG22 HD11 ' A' ' 46' ' ' LEU . 40.7 t -98.61 117.18 43.21 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 C-N-CA 123.114 0.566 . . . . 73.45 110.236 -174.069 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 54.4 tp60 -91.71 147.57 22.9 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.806 1.243 . . . . 75.21 109.168 175.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 79.9 t -87.92 121.2 38.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 N-CA-C 108.343 -0.984 . . . . 61.54 108.343 170.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.3 tpt180 -94.72 -59.62 1.88 Allowed 'General case' 0 N--CA 1.477 0.88 0 O-C-N 123.295 0.372 . . . . 74.31 110.242 -178.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 50.3 mtt180 -148.53 165.2 31.93 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 124.321 1.048 . . . . 74.43 110.166 -179.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 82.0 t -137.16 132.78 46.87 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 C-N-CA 124.346 1.059 . . . . 73.24 109.127 178.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.409 ' HB2' ' HB2' ' A' ' 41' ' ' ARG . 69.2 mm-40 -125.46 108.57 11.76 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.332 1.053 . . . . 73.5 108.814 -177.213 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.5 tmtt? -92.87 106.92 18.81 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 108.042 -1.096 . . . . 73.54 108.042 -176.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.2 mm-40 -120.51 89.01 3.04 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.443 0.697 . . . . 74.05 109.791 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.6 -98.58 0.41 Allowed Glycine 0 C--N 1.35 1.339 0 CA-C-N 115.598 -0.728 . . . . 72.33 112.501 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.417 HD21 ' HB3' ' A' ' 61' ' ' ARG . 16.7 m120 -105.87 -26.16 11.84 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.738 0.815 . . . . 70.12 110.349 175.125 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 25.1 m -87.77 98.68 11.59 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.406 0.683 . . . . 74.31 110.475 -177.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.515 HD12 HG21 ' A' ' 11' ' ' VAL . 40.1 mt -90.12 108.47 19.51 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 CA-C-N 116.085 -0.507 . . . . 75.21 109.867 171.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.581 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 91.6 mtt180 -84.12 105.8 15.27 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.402 1.081 . . . . 70.42 109.388 174.44 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.1 t -95.19 118.94 42.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 N-CA-C 108.721 -0.844 . . . . 63.43 108.721 174.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.466 ' HG3' ' HG1' ' A' ' 56' ' ' THR . 3.8 mp0 -83.74 115.24 22.11 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 107.992 -1.114 . . . . 75.13 107.992 168.271 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.7 mp -108.71 170.83 7.78 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.887 -0.783 . . . . 63.23 108.887 174.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -135.75 107.68 7.11 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.862 -0.792 . . . . 74.52 108.862 -168.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.506 HD11 HG22 ' A' ' 28' ' ' VAL . 9.2 tt -127.71 138.15 52.69 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.831 1.252 . . . . 75.44 108.697 -168.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 48.9 mtm105 -102.42 99.83 9.92 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 122.828 0.451 . . . . 75.23 110.923 -175.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 1.9 m -98.5 116.89 31.69 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.795 0.838 . . . . 62.03 110.225 -179.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 61.93 30.42 18.08 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 124.324 1.05 . . . . 72.22 112.498 174.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 84.45 5.91 86.47 Favored Glycine 0 C--N 1.343 0.964 0 CA-C-N 116.131 -0.486 . . . . 54.22 113.092 -178.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.512 ' HA ' ' HE2' ' A' ' 51' ' ' LYS . 9.9 mmpt? -110.97 127.16 55.41 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.629 0.772 . . . . 71.42 109.813 175.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -79.61 113.57 17.86 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 108.209 -1.034 . . . . 64.23 108.209 176.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -120.51 127.82 52.54 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.773 1.229 . . . . 74.22 109.091 178.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -88.58 130.02 35.35 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 109.163 -0.681 . . . . 73.33 109.163 175.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -114.22 118.71 34.74 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 109.279 -0.637 . . . . 72.45 109.279 178.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.466 ' HG1' ' HG3' ' A' ' 43' ' ' GLU . 38.4 m -86.16 100.7 12.4 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 108.458 -0.942 . . . . 75.42 108.458 172.367 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.448 HG13 ' HA ' ' A' ' 15' ' ' ALA . 60.1 t -92.91 106.52 18.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 N-CA-C 108.411 -0.959 . . . . 74.23 108.411 178.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.581 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 33.1 mt-10 -77.31 107.6 9.83 Favored 'General case' 0 C--O 1.222 -0.353 0 N-CA-C 108.056 -1.09 . . . . 63.51 108.056 178.213 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.507 HG23 HG21 ' A' ' 68' ' ' VAL . 38.8 t -112.14 124.38 68.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 N-CA-C 109.006 -0.739 . . . . 75.43 109.006 176.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -112.92 147.51 36.92 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.499 0.719 . . . . 72.24 110.128 -177.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.417 ' HB3' HD21 ' A' ' 38' ' ' ASN . 9.8 tpt180 -74.96 106.78 6.63 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.372 -0.831 . . . . 75.23 110.357 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 22.7 tp60 -91.22 79.12 5.73 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 108.388 -0.968 . . . . 75.0 108.388 174.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 73.24 -100.53 1.05 Allowed Glycine 0 C--N 1.348 1.215 0 CA-C-N 114.986 -1.006 . . . . 74.33 112.366 -179.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -95.0 -32.2 13.26 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.142 0.977 . . . . 62.22 110.265 176.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.8 p -96.08 176.46 6.08 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.687 0.795 . . . . 71.14 111.358 -175.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . 0.407 ' HZ2' ' HB3' ' A' ' 7' ' ' GLU . 96.3 m95 -119.08 149.07 42.3 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.844 1.258 . . . . 72.5 109.934 179.21 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 14.9 t -147.92 140.19 24.31 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.276 0.63 . . . . 65.32 110.281 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.507 HG21 HG23 ' A' ' 59' ' ' VAL . 76.4 t -80.78 114.15 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 123.047 0.539 . . . . 73.24 110.815 -177.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -65.41 -54.75 24.18 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.743 1.217 . . . . 74.41 110.85 175.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 2.3 tpm_? -163.36 132.18 3.92 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.608 -0.723 . . . . 74.23 110.012 -178.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 63.5 mt -87.76 107.4 17.29 Favored 'Isoleucine or valine' 0 C--O 1.24 0.568 0 N-CA-C 107.828 -1.175 . . . . 70.35 107.828 167.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 22.2 m -98.48 115.5 28.68 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.112 -0.949 . . . . 74.43 108.773 -178.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 11.8 ttm180 -69.49 149.31 48.4 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 108.883 -0.784 . . . . 75.43 108.883 171.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 8.1 t -59.94 152.82 22.65 Favored 'General case' 0 C--O 1.245 0.867 0 C-N-CA 123.0 0.52 . . . . 73.44 110.307 173.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 7.6 p -61.85 123.9 15.4 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 N-CA-C 109.441 -0.577 . . . . 75.43 109.441 176.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 165.34 -92.38 0.11 Allowed Glycine 0 C--N 1.333 0.385 0 N-CA-C 110.202 -1.159 . . . . 72.23 110.202 -175.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 36.6 t -81.38 80.07 7.86 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 108.976 -0.75 . . . . 64.23 108.976 176.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 68.0 tp -90.43 136.18 33.22 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.387 -0.824 . . . . 75.33 109.444 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -65.75 129.93 41.49 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 123.926 0.766 . . . . 71.32 109.69 174.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 11.5 p80 -82.53 61.69 5.8 Favored 'General case' 0 N--CA 1.482 1.125 0 CA-C-O 122.167 0.984 . . . . 73.44 110.343 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 26.3 p80 -67.35 134.12 50.91 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 114.616 -1.175 . . . . 75.33 111.279 -173.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 33.9 t60 -129.17 117.31 20.58 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.909 0.884 . . . . 72.31 109.032 178.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 50.7 m-70 -131.19 134.63 46.68 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 108.513 -0.921 . . . . 63.34 108.513 178.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 8.9 p80 -61.1 140.75 57.8 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.6 0.76 . . . . 72.23 111.558 -173.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 10.4 p-80 . . . . . 0 CA--C 1.552 1.055 0 CA-C-O 118.916 -0.564 . . . . 71.44 109.891 173.296 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.8 mmt . . . . . 0 N--CA 1.484 1.273 0 N-CA-C 110.233 -0.284 . . . . 72.23 110.233 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -76.39 72.6 5.41 Favored 'Trans proline' 0 C--N 1.37 1.708 0 C-N-CA 122.15 1.9 . . . . 74.22 110.324 175.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.1 t -62.38 -28.0 69.47 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.968 0.907 . . . . 74.25 112.966 -168.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -66.65 -49.13 67.23 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.938 0.495 . . . . 73.12 110.13 172.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -75.63 -19.29 59.31 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.847 1.259 . . . . 53.44 111.251 -179.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -64.18 -14.31 54.37 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.372 1.069 . . . . 64.4 111.822 -174.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -46.28 -53.23 11.11 Favored 'General case' 0 C--O 1.209 -1.037 0 C-N-CA 123.764 0.825 . . . . 74.52 109.948 165.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.647 ' HG3' HG12 ' A' ' 33' ' ' VAL . 1.1 mptm? -58.57 -45.34 89.2 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.312 1.045 . . . . 75.14 111.208 179.478 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 28.3 mmm180 -55.97 -42.24 75.98 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.857 0.863 . . . . 75.23 110.881 -177.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -78.57 -55.13 5.44 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 114.773 -1.103 . . . . 52.34 111.34 -178.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.406 HG22 HD12 ' A' ' 40' ' ' ILE . 73.9 t -65.81 -37.58 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 124.842 1.257 . . . . 73.24 113.218 -166.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.459 ' HG3' ' O ' ' A' ' 8' ' ' LYS . 22.3 mtmm -64.01 -38.12 89.92 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-N 118.163 0.438 . . . . 75.41 109.903 178.463 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.529 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.5 tt0 -69.05 -45.53 70.18 Favored 'General case' 0 C--N 1.352 0.679 0 CA-C-N 115.349 -0.841 . . . . 64.44 110.494 178.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.475 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 92.8 t -60.19 -41.51 86.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 123.228 0.611 . . . . 73.44 109.99 177.205 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.76 -39.08 76.92 Favored 'General case' 0 C--O 1.244 0.769 0 C-N-CA 124.213 1.005 . . . . 75.51 111.927 -176.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.438 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 21.6 ptmt -71.87 -30.89 65.9 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 119.297 -0.383 . . . . 62.12 110.566 -179.128 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.529 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 24.4 mm-40 -61.91 -41.77 98.31 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 123.609 0.568 . . . . 74.44 110.4 174.232 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.54 ' HB3' HD12 ' A' ' 71' ' ' ILE . 2.1 mmmp? -61.41 -36.54 80.6 Favored 'General case' 0 CA--C 1.55 0.948 0 O-C-N 124.048 0.842 . . . . 73.34 110.507 178.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.585 ' HB3' HD11 ' A' ' 46' ' ' LEU . 52.0 mt -76.07 -31.91 59.0 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.788 0.835 . . . . 75.34 112.436 177.276 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 93.3 mt -73.11 -25.44 60.86 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.987 0.515 . . . . 62.44 110.902 178.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.462 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 49.5 mt-10 -65.11 -42.71 93.71 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-O 121.293 0.568 . . . . 73.1 110.149 171.82 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -71.37 -36.3 71.4 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 115.044 -0.98 . . . . 71.53 111.238 178.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.2 t -148.88 89.75 4.91 Favored Pre-proline 0 CA--C 1.544 0.716 0 CA-C-N 115.836 -0.62 . . . . 71.24 109.688 -175.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -70.37 -17.46 34.78 Favored 'Trans proline' 0 C--N 1.377 2.034 0 C-N-CA 122.828 2.352 . . . . 74.35 111.609 172.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -79.59 -10.73 59.85 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.338 1.055 . . . . 61.43 112.099 -176.315 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 68.7 p -104.8 157.0 17.5 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.514 0.726 . . . . 72.1 111.672 -178.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.482 ' HE3' ' HA ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -102.86 124.18 47.91 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 108.353 -0.98 . . . . 74.31 108.353 164.626 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 49.4 t -101.4 114.22 39.96 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 123.796 0.838 . . . . 72.54 109.958 -178.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -93.53 165.11 12.91 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 124.322 1.049 . . . . 74.31 108.693 171.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.453 HG23 ' HD2' ' A' ' 12' ' ' LYS . 4.0 p -81.92 132.5 31.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 N-CA-C 109.0 -0.741 . . . . 74.41 109.0 165.203 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 -100.93 -44.21 5.82 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.362 0.665 . . . . 74.22 109.933 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -167.67 151.02 6.11 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 108.024 -1.102 . . . . 72.43 108.024 -175.039 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.647 HG12 ' HG3' ' A' ' 8' ' ' LYS . 65.8 t -129.62 130.77 67.11 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 123.487 0.715 . . . . 60.33 109.297 176.163 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -121.88 108.11 13.07 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.06 0.944 . . . . 70.11 109.801 177.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -92.17 109.68 21.05 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 108.395 -0.965 . . . . 74.34 108.395 171.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -122.52 90.13 3.24 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.768 0.827 . . . . 73.03 109.598 -178.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.26 -85.38 0.1 Allowed Glycine 0 C--N 1.348 1.2 0 CA-C-N 115.78 -0.645 . . . . 54.53 114.218 173.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -118.2 4.44 11.95 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 124.303 1.041 . . . . 64.0 111.869 -176.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 47.5 m -142.18 119.47 11.51 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.815 0.446 . . . . 62.15 111.043 -174.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.406 HD12 HG22 ' A' ' 11' ' ' VAL . 24.5 mt -94.75 108.12 20.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 123.171 0.588 . . . . 73.35 109.758 171.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 11.9 mtm180 -90.12 99.98 12.89 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 107.365 -1.346 . . . . 74.31 107.365 174.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.428 HG11 HG21 ' A' ' 33' ' ' VAL . 40.5 t -91.07 116.53 32.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 N-CA-C 108.911 -0.774 . . . . 75.35 108.911 178.228 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -79.15 127.04 31.52 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 107.652 -1.24 . . . . 74.31 107.652 167.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.8 mp -124.22 154.42 40.18 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 109.386 -0.598 . . . . 74.01 109.386 177.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -107.27 104.5 14.13 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 108.932 -0.766 . . . . 74.43 108.932 -177.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.585 HD11 ' HB3' ' A' ' 19' ' ' LEU . 9.5 tt -100.76 126.53 47.32 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 108.244 -1.021 . . . . 64.21 108.244 -178.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -125.58 101.57 6.97 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 122.884 0.473 . . . . 74.14 110.949 -173.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 16.0 m -110.44 119.05 37.93 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.15 0.58 . . . . 74.53 109.936 -177.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 61.75 24.05 14.24 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.482 1.113 . . . . 72.32 111.831 172.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.76 -14.7 61.57 Favored Glycine 0 C--N 1.353 1.5 0 CA-C-O 119.319 -0.712 . . . . 63.32 113.496 178.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.24 148.15 29.62 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 118.239 1.019 . . . . 71.4 108.621 173.336 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -118.15 134.72 54.74 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.616 0.766 . . . . 72.52 109.313 176.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -145.29 127.87 16.1 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 108.597 -0.89 . . . . 62.04 108.597 174.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.453 ' N ' HD21 ' A' ' 54' ' ' ASN . 0.7 OUTLIER -86.85 143.04 27.63 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.975 0.91 . . . . 74.53 109.3 -178.529 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -132.07 120.25 22.11 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.018 0.527 . . . . 72.43 110.007 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 91.0 m -84.98 100.29 11.56 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 108.825 -0.805 . . . . 63.35 108.825 170.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 71.2 t -93.02 103.86 15.12 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 N-CA-C 107.047 -1.464 . . . . 71.24 107.047 174.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.424 ' HB2' ' HB2' ' A' ' 69' ' ' LYS . 41.1 mt-10 -79.41 114.58 18.46 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 114.917 -1.038 . . . . 75.34 108.583 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 44.5 t -115.73 122.2 68.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 124.047 0.939 . . . . 75.11 108.61 177.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.462 ' HB2' ' HD3' ' A' ' 69' ' ' LYS . 35.9 tt0 -100.59 144.68 29.28 Favored 'General case' 0 C--O 1.241 0.653 0 C-N-CA 124.426 1.09 . . . . 75.12 109.827 -173.399 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 26.0 tpt180 -80.73 105.5 12.01 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.388 0.675 . . . . 75.42 109.447 174.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -108.12 89.47 3.01 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.375 1.07 . . . . 73.41 108.208 179.079 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 71.0 -107.51 2.19 Favored Glycine 0 CA--C 1.529 0.965 0 N-CA-C 111.693 -0.563 . . . . 71.44 111.693 -174.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -113.6 -3.57 13.6 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.882 0.873 . . . . 73.43 109.99 174.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 32.8 p -99.02 172.55 7.33 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.329 0.585 . . . . 74.3 111.096 176.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -119.49 140.72 50.02 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.876 1.27 . . . . 71.23 109.227 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 9.0 t -140.28 124.32 17.54 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 121.196 0.522 . . . . 73.32 110.453 -178.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 90.0 t -75.28 114.36 15.24 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 C-N-CA 123.287 0.635 . . . . 73.21 110.17 -177.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.462 ' HD3' ' HB2' ' A' ' 60' ' ' GLU . 32.1 mmmt -64.93 -50.4 66.61 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.626 1.171 . . . . 62.35 110.43 176.208 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -170.37 165.1 8.8 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 124.508 1.13 . . . . 72.45 110.035 175.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.54 HD12 ' HB3' ' A' ' 18' ' ' LYS . 75.1 mt -101.44 107.22 20.99 Favored 'Isoleucine or valine' 0 C--O 1.24 0.593 0 N-CA-C 107.491 -1.299 . . . . 70.42 107.491 166.038 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 12.3 m -92.87 114.58 27.18 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 109.299 -0.63 . . . . 75.11 109.299 -178.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 -68.05 141.47 56.16 Favored 'General case' 0 C--O 1.245 0.816 0 N-CA-C 109.037 -0.727 . . . . 74.2 109.037 169.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.5 t -64.38 137.84 58.11 Favored 'General case' 0 C--O 1.245 0.845 0 N-CA-C 109.112 -0.699 . . . . 71.21 109.112 173.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.496 HG21 ' HB3' ' A' ' 78' ' ' LEU . 14.2 p -121.3 134.33 65.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 108.462 -0.94 . . . . 51.41 108.462 -176.395 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -163.36 100.86 0.18 Allowed Glycine 0 N--CA 1.466 0.646 0 N-CA-C 109.619 -1.392 . . . . 63.13 109.619 -178.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.1 m 61.16 22.34 12.66 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.288 1.035 . . . . 74.24 111.244 -171.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.496 ' HB3' HG21 ' A' ' 75' ' ' VAL . 6.5 tt -109.14 131.09 55.4 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 107.74 -1.207 . . . . 74.22 107.74 -176.398 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -73.2 93.86 1.9 Allowed 'General case' 0 C--O 1.24 0.571 0 O-C-N 123.651 0.594 . . . . 52.01 109.948 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.44 ' HD1' HG23 ' A' ' 75' ' ' VAL . 21.1 p-80 -74.92 83.38 2.2 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 107.717 -1.216 . . . . 75.53 107.717 170.048 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 30.0 t60 -63.79 119.53 10.15 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 114.233 -1.349 . . . . 55.3 110.285 -170.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 57.4 m80 -69.27 103.09 1.86 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.596 1.158 . . . . 74.11 111.179 -173.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 20.5 t-80 -118.9 123.98 45.98 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.061 -1.089 . . . . 74.32 108.061 174.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -67.58 137.04 55.39 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.204 0.602 . . . . 74.24 110.956 -173.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 9.7 p80 . . . . . 0 N--CA 1.478 0.943 0 C-N-CA 124.738 1.215 . . . . 74.13 109.128 177.772 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 46.0 ttm . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 109.99 -0.374 . . . . 75.33 109.99 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -84.35 115.26 1.91 Allowed 'Trans proline' 0 C--N 1.375 1.945 0 C-N-CA 122.472 2.115 . . . . 74.25 110.648 172.087 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 69.7 p -102.77 9.4 39.08 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.309 0.644 . . . . 72.42 111.593 -178.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -61.48 -52.67 63.55 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.3 1.04 . . . . 65.33 111.659 -174.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.452 ' HA ' ' HD3' ' A' ' 8' ' ' LYS . 17.0 tp10 -70.11 -28.42 65.38 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-N 116.128 -0.487 . . . . 71.35 110.587 -179.421 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -67.59 -28.76 68.04 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.252 1.021 . . . . 73.23 111.138 178.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -56.69 -44.08 81.13 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.333 0.653 . . . . 62.33 110.309 174.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.452 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 0.1 OUTLIER -64.67 -45.47 86.58 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 124.059 0.849 . . . . 75.03 108.977 177.592 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 21.7 mtm180 -58.25 -40.02 80.68 Favored 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 123.866 0.866 . . . . 75.54 111.649 -178.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -67.57 -55.12 14.66 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.128 0.971 . . . . 74.01 110.314 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.574 HG22 HD12 ' A' ' 40' ' ' ILE . 72.4 t -64.97 -36.31 77.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 123.811 0.844 . . . . 75.3 112.436 -172.504 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.633 ' HZ3' ' HB2' ' A' ' 12' ' ' LYS . 10.3 mtmp? -65.4 -42.63 92.39 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.658 0.383 . . . . 72.11 110.26 176.362 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.495 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.2 tt0 -66.09 -49.29 68.1 Favored 'General case' 0 C--N 1.352 0.691 0 O-C-N 123.866 0.729 . . . . 64.14 110.217 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.475 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 84.6 t -57.87 -46.23 87.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 123.232 0.613 . . . . 74.43 109.862 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.467 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -60.25 -51.61 68.84 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.77 0.828 . . . . 62.2 112.295 -178.305 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -63.4 -39.5 94.67 Favored 'General case' 0 C--N 1.351 0.633 0 O-C-N 123.924 0.765 . . . . 73.32 110.406 -178.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 33.4 mm-40 -66.59 -40.66 89.0 Favored 'General case' 0 C--N 1.353 0.748 0 O-C-N 123.409 0.443 . . . . 74.4 110.975 178.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 73.4 mmtt -64.17 -35.31 80.38 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.484 0.714 . . . . 65.12 110.95 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.601 ' HB3' HD13 ' A' ' 46' ' ' LEU . 61.5 mt -75.5 -30.44 59.85 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.627 -0.715 . . . . 75.11 111.545 175.686 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.0 mt -73.29 -28.4 62.09 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.523 0.729 . . . . 72.5 110.978 174.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 24.4 mm-40 -59.24 -36.35 75.29 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 123.29 0.636 . . . . 75.32 110.172 174.458 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -91.83 -30.4 16.22 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 114.444 -1.253 . . . . 74.1 111.199 -175.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.2 t -148.81 88.33 5.24 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 122.82 0.448 . . . . 52.14 110.685 -175.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -76.04 -20.91 14.46 Favored 'Trans proline' 0 C--N 1.383 2.359 0 C-N-CA 123.155 2.57 . . . . 75.42 113.367 178.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -78.31 -13.18 59.96 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.346 0.658 . . . . 74.11 111.733 -176.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 54.0 p -105.87 135.5 47.18 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.577 0.751 . . . . 71.34 110.487 177.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -75.06 126.61 31.38 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 108.708 -0.849 . . . . 73.34 108.708 167.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 58.6 t -100.85 112.91 35.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 109.421 -0.585 . . . . 75.2 109.421 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.505 ' HB2' ' HB3' ' A' ' 45' ' ' GLU . 15.8 mm100 -100.0 123.76 44.61 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.909 1.284 . . . . 75.12 109.397 -178.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 p -64.88 115.78 3.52 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 N-CA-C 109.121 -0.696 . . . . 74.14 109.121 173.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 -96.53 -42.14 8.22 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.716 -0.675 . . . . 73.05 110.25 -171.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.474 ' HB3' ' HB2' ' A' ' 43' ' ' GLU . 60.6 ttt180 -154.71 143.79 21.05 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.463 0.705 . . . . 75.14 110.181 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.8 t -114.63 110.69 32.97 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 N-CA-C 107.982 -1.118 . . . . 71.31 107.982 173.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 23.7 tp60 -125.7 117.07 22.69 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 118.162 0.437 . . . . 74.44 111.308 -174.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.6 tppp? -78.23 134.66 37.55 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.905 0.882 . . . . 54.41 110.59 178.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.8 mm-40 -128.43 84.05 2.21 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.365 1.066 . . . . 73.53 108.331 170.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.43 -93.18 0.7 Allowed Glycine 0 C--N 1.35 1.344 0 CA-C-N 115.83 -0.623 . . . . 74.24 111.618 -175.312 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.488 ' HB3' ' HB3' ' A' ' 61' ' ' ARG . 3.9 m-20 -119.27 -13.07 9.34 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 123.557 0.743 . . . . 65.23 110.299 173.3 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.622 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 21.2 m -91.84 99.25 12.15 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 123.685 0.794 . . . . 72.04 110.177 -179.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.574 HD12 HG22 ' A' ' 11' ' ' VAL . 37.9 mt -76.55 107.77 8.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 N-CA-C 108.988 -0.745 . . . . 74.3 108.988 175.071 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.448 HH21 HG23 ' A' ' 56' ' ' THR . 54.0 mtp180 -83.68 95.4 8.37 Favored 'General case' 0 C--O 1.24 0.603 0 N-CA-C 107.508 -1.293 . . . . 73.22 107.508 169.133 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.4 HG23 ' HB3' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -85.02 123.31 39.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 N-CA-C 108.685 -0.857 . . . . 71.44 108.685 173.948 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.474 ' HB2' ' HB3' ' A' ' 32' ' ' ARG . 45.0 mt-10 -89.33 130.51 35.7 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 123.943 0.897 . . . . 63.23 108.748 170.367 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.2 mp -130.2 168.68 16.44 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.214 0.53 . . . . 72.24 110.108 179.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.505 ' HB3' ' HB2' ' A' ' 29' ' ' GLN . 31.1 tt0 -118.24 119.33 34.36 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 125.455 1.502 . . . . 73.32 108.508 -174.177 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.601 HD13 ' HB3' ' A' ' 19' ' ' LEU . 8.1 tt -133.36 129.85 38.01 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.077 -1.453 . . . . 75.14 107.077 -176.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 50.8 mtp180 -100.28 102.76 14.11 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.147 0.579 . . . . 74.43 109.882 -175.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.1 m -101.09 122.64 43.94 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 108.589 -0.893 . . . . 64.23 108.589 179.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 60.74 24.87 14.72 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 124.075 0.95 . . . . 73.44 111.789 174.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 96.17 -21.4 45.48 Favored Glycine 0 C--N 1.35 1.336 0 CA-C-N 115.902 -0.59 . . . . 72.01 113.049 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -84.56 157.24 21.3 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.044 0.938 . . . . 73.41 110.063 -179.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -111.97 105.95 14.51 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.281 0.632 . . . . 74.51 111.172 -173.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.533 ' HG2' ' HD2' ' A' ' 73' ' ' ARG . 13.2 mp0 -105.11 143.37 33.38 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.055 0.942 . . . . 62.32 110.299 179.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -93.96 131.63 39.22 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 108.949 -0.76 . . . . 74.42 108.949 173.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.526 ' CE2' ' HB3' ' A' ' 46' ' ' LEU . 20.9 m-85 -120.44 121.45 38.55 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.535 0.734 . . . . 74.41 109.726 178.466 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.448 HG23 HH21 ' A' ' 41' ' ' ARG . 25.1 m -87.63 103.88 15.99 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.757 0.823 . . . . 45.33 109.455 173.56 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.467 HG11 ' HA ' ' A' ' 15' ' ' ALA . 48.9 t -93.74 105.26 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 N-CA-C 107.55 -1.278 . . . . 54.45 107.55 172.621 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -88.49 100.11 12.81 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 108.407 -0.961 . . . . 64.03 108.407 -177.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.579 HG23 HG21 ' A' ' 68' ' ' VAL . 29.1 t -104.03 118.92 51.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 123.792 0.837 . . . . 64.34 108.948 -178.63 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.622 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 31.0 tt0 -101.07 146.47 27.4 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.089 0.956 . . . . 64.44 110.114 -177.432 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.488 ' HB3' ' HB3' ' A' ' 38' ' ' ASN . 7.7 tpp180 -74.31 142.16 45.21 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 116.158 -0.474 . . . . 71.11 110.106 173.416 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -142.61 83.3 1.81 Allowed 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 108.123 -1.066 . . . . 71.21 108.123 175.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.21 -104.07 1.2 Allowed Glycine 0 C--N 1.345 1.08 0 CA-C-N 115.33 -0.85 . . . . 62.44 112.032 -176.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -101.84 -19.18 15.41 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.123 0.569 . . . . 74.43 111.091 179.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.6 t -100.25 172.9 6.88 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 122.869 0.468 . . . . 74.1 111.319 -176.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -123.08 120.96 34.83 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.605 1.162 . . . . 74.44 109.208 179.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.9 t -111.97 120.5 42.12 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 123.918 0.887 . . . . 72.41 110.484 179.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.579 HG21 HG23 ' A' ' 59' ' ' VAL . 58.9 t -74.81 120.18 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 N-CA-C 109.68 -0.489 . . . . 70.15 109.68 179.092 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.415 ' HA ' ' HE2' ' A' ' 69' ' ' LYS . 11.5 mmpt? -76.59 -55.59 5.38 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.394 1.077 . . . . 71.21 110.923 -179.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 23.2 ttt85 -163.68 125.73 2.46 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.687 -0.688 . . . . 75.3 110.412 -172.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.43 HD13 ' HB3' ' A' ' 18' ' ' LYS . 57.1 mt -93.35 131.05 41.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 N-CA-C 107.917 -1.142 . . . . 73.04 107.917 167.5 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 84.7 m -137.91 125.48 22.14 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 123.516 0.726 . . . . 64.12 109.689 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.533 ' HD2' ' HG2' ' A' ' 53' ' ' GLU . 36.7 ttp85 -75.37 144.65 42.19 Favored 'General case' 0 C--O 1.242 0.701 0 N-CA-C 108.43 -0.952 . . . . 72.14 108.43 170.126 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.3 t -57.78 148.08 26.16 Favored 'General case' 0 C--O 1.249 1.073 0 C-N-CA 123.478 0.711 . . . . 73.24 109.55 172.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 77.4 t -63.57 98.03 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.355 0.837 0 CA-C-O 121.662 0.744 . . . . 74.3 109.213 -178.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -119.44 34.28 4.33 Favored Glycine 0 C--N 1.339 0.696 0 CA-C-N 114.271 -1.331 . . . . 45.44 109.778 175.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.1 t -147.64 -167.64 2.85 Favored 'General case' 0 C--O 1.243 0.747 0 C-N-CA 125.293 1.437 . . . . 75.42 107.431 -175.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -65.19 145.85 55.72 Favored 'General case' 0 C--O 1.249 1.065 0 N-CA-C 109.647 -0.501 . . . . 73.4 109.647 171.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -75.92 86.02 2.86 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.298 -0.865 . . . . 75.42 109.091 178.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 8.7 p-80 -56.99 90.28 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.892 1.677 . . . . 64.01 112.804 -174.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 35.0 t-80 -86.7 121.4 29.16 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 109.309 -0.626 . . . . 74.21 109.309 173.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 7.3 p80 -119.75 162.13 19.57 Favored 'General case' 0 C--O 1.244 0.772 0 C-N-CA 123.845 0.858 . . . . 74.13 108.691 176.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -78.37 153.24 31.79 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 120.875 0.369 . . . . 72.34 111.329 -177.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 47.5 t-80 -109.92 94.28 4.94 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 108.045 -1.094 . . . . 72.24 108.045 173.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 65.0 t60 . . . . . 0 C--O 1.25 1.095 0 N-CA-C 108.981 -0.748 . . . . 74.35 108.981 179.313 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.0 mmm . . . . . 0 CA--C 1.549 0.92 0 N-CA-C 109.137 -0.69 . . . . 63.34 109.137 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -73.64 116.55 4.72 Favored 'Trans proline' 0 C--N 1.378 2.125 0 C-N-CA 122.514 2.142 . . . . 70.41 111.292 -179.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 89.4 p -74.46 143.6 44.59 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 108.856 -0.794 . . . . 75.13 108.856 176.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.452 ' O ' ' HD3' ' A' ' 8' ' ' LYS . 28.7 tt0 -64.56 -30.27 71.3 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 110.507 -0.182 . . . . 72.52 110.507 -178.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.429 ' HA ' ' HE2' ' A' ' 8' ' ' LYS . 44.9 tt0 -65.56 -36.62 84.32 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 122.964 0.505 . . . . 74.55 111.077 176.143 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -62.45 -35.11 78.27 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.411 0.684 . . . . 73.22 109.912 171.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.511 ' O ' HG23 ' A' ' 11' ' ' VAL . 29.6 mm-40 -67.48 -49.47 63.4 Favored 'General case' 0 C--N 1.35 0.599 0 CA-C-O 118.604 -0.712 . . . . 75.3 110.413 -179.503 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.663 ' HG3' HD11 ' A' ' 40' ' ' ILE . 4.0 mppt? -57.16 -37.33 71.92 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-N 118.228 0.467 . . . . 54.3 111.321 175.267 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.563 ' HA ' ' HE2' ' A' ' 12' ' ' LYS . 77.0 ttt180 -59.51 -43.53 93.37 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 123.642 0.589 . . . . 75.05 110.772 177.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.47 ' O ' HG21 ' A' ' 14' ' ' VAL . 48.8 mt-30 -64.76 -43.67 92.57 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 115.122 -0.945 . . . . 72.23 110.53 175.203 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 7' ' ' GLU . 74.7 t -62.81 -39.07 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 C-N-CA 124.499 1.12 . . . . 73.5 111.961 -176.27 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.563 ' HE2' ' HA ' ' A' ' 9' ' ' ARG . 49.7 mtmt -64.55 -36.16 83.31 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.291 0.637 . . . . 63.4 110.57 178.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.513 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.6 tt0 -67.09 -49.11 66.1 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 124.067 0.854 . . . . 73.31 109.889 175.399 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.47 HG21 ' O ' ' A' ' 10' ' ' GLN . 61.3 t -59.06 -32.42 47.81 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 123.387 0.675 . . . . 74.11 110.571 178.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.474 ' HA ' HG13 ' A' ' 57' ' ' VAL . . . -73.15 -49.36 28.68 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.254 1.021 . . . . 65.32 111.975 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -68.95 -36.64 78.15 Favored 'General case' 0 N--CA 1.479 1.008 0 O-C-N 123.753 0.658 . . . . 75.43 111.416 -173.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.513 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 16.0 mm-40 -64.65 -39.76 94.27 Favored 'General case' 0 C--N 1.353 0.719 0 O-C-N 123.711 0.632 . . . . 74.11 110.821 -177.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -73.76 -29.92 62.49 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.122 0.569 . . . . 75.13 111.52 -178.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.515 HD21 ' NE2' ' A' ' 22' ' ' GLN . 64.7 mt -71.09 -32.17 68.73 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.041 0.537 . . . . 62.5 111.41 171.215 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.9 mt -71.02 -32.42 69.18 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.306 0.642 . . . . 72.33 110.222 173.091 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 21.8 mm-40 -61.86 -44.53 96.64 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.147 0.579 . . . . 71.24 110.306 176.08 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.515 ' NE2' HD21 ' A' ' 19' ' ' LEU . 48.0 mt-30 -71.01 -42.91 68.96 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.109 -0.95 . . . . 61.34 111.457 -179.147 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.9 t -138.82 91.74 11.62 Favored Pre-proline 0 C--O 1.241 0.632 0 CA-C-N 116.03 -0.532 . . . . 74.11 110.483 -177.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -72.33 -12.38 27.45 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 122.925 2.417 . . . . 73.33 111.539 165.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -69.98 -25.06 63.44 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 124.685 1.194 . . . . 73.32 111.236 177.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 7.4 m -116.95 146.25 43.11 Favored 'General case' 0 C--O 1.239 0.548 0 C-N-CA 123.705 0.802 . . . . 73.23 110.758 -176.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -94.65 120.94 35.67 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 107.648 -1.242 . . . . 61.35 107.648 172.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 47.6 t -97.56 135.42 32.01 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 C-N-CA 123.812 0.845 . . . . 74.35 109.481 -173.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 54.8 tp60 -130.99 133.69 46.02 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.449 0.7 . . . . 73.31 109.312 -178.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.542 HG13 ' HD2' ' A' ' 12' ' ' LYS . 53.5 t -59.95 118.84 3.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 123.101 0.561 . . . . 75.13 110.463 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.412 ' H ' ' HA ' ' A' ' 44' ' ' LEU . 26.3 tpt180 -90.4 -49.47 6.5 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.514 0.726 . . . . 73.21 109.701 -173.253 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 18.8 ttt180 -160.86 151.39 18.13 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.845 0.858 . . . . 61.14 109.774 -178.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.404 HG23 ' HD3' ' A' ' 12' ' ' LYS . 64.1 t -114.97 128.43 72.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 123.62 0.768 . . . . 75.02 109.214 173.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -117.22 137.6 52.26 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 124.677 1.191 . . . . 72.11 107.897 176.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -107.54 119.99 40.95 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 107.364 -1.347 . . . . 74.31 107.364 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -130.7 75.66 1.67 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.714 0.806 . . . . 71.33 108.882 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 63.02 -114.48 6.94 Favored Glycine 0 C--N 1.348 1.21 0 CA-C-N 114.932 -1.031 . . . . 51.53 112.724 -178.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -82.89 -21.16 34.32 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.111 0.565 . . . . 74.12 110.906 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.446 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 24.7 m -100.62 104.22 15.54 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.704 0.801 . . . . 73.22 110.67 -178.628 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.663 HD11 ' HG3' ' A' ' 8' ' ' LYS . 77.9 mt -83.77 109.12 16.91 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 N-CA-C 108.806 -0.812 . . . . 73.14 108.806 172.598 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.576 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 64.2 mtt180 -88.84 95.46 10.3 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.133 0.973 . . . . 70.5 110.045 -179.328 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 57.0 t -87.92 110.71 21.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 N-CA-C 109.08 -0.711 . . . . 72.23 109.08 176.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.452 ' HG2' ' HG1' ' A' ' 56' ' ' THR . 42.3 mt-10 -76.43 134.1 39.68 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 109.429 -0.582 . . . . 73.24 109.429 169.122 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.412 ' HA ' ' H ' ' A' ' 31' ' ' ARG . 4.3 mp -131.78 168.4 17.87 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.058 0.543 . . . . 72.05 109.803 174.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -110.17 130.15 55.59 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 107.615 -1.254 . . . . 72.43 107.615 -179.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.61 ' HB3' ' CE2' ' A' ' 55' ' ' TYR . 6.8 tt -139.74 135.66 33.35 Favored 'General case' 0 C--O 1.249 1.057 0 N-CA-C 106.472 -1.677 . . . . 73.12 106.472 -179.516 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 83.1 mtt180 -103.39 99.52 9.36 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.448 -0.796 . . . . 74.02 110.557 -166.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 36.3 m -72.73 87.11 1.25 Allowed 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 108.901 -0.777 . . . . 72.52 108.901 176.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 55.4 m-20 60.48 31.78 20.37 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 124.734 1.214 . . . . 65.44 110.555 -171.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.15 -10.16 59.89 Favored Glycine 0 C--N 1.351 1.404 0 CA-C-N 115.666 -0.697 . . . . 64.42 114.31 -177.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.563 ' HE3' ' HA ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -75.47 129.09 36.72 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 117.93 0.865 . . . . 73.44 110.362 179.065 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.571 ' HZ1' ' HB3' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -81.78 115.65 21.1 Favored 'General case' 0 C--O 1.238 0.48 0 C-N-CA 123.599 0.76 . . . . 75.43 109.814 -172.992 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 14.5 mp0 -129.6 139.31 51.5 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.346 0.658 . . . . 70.13 109.722 170.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -92.56 122.55 35.09 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.913 0.885 . . . . 64.13 109.181 172.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.61 ' CE2' ' HB3' ' A' ' 46' ' ' LEU . 12.0 m-85 -107.23 116.7 32.4 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 108.472 -0.936 . . . . 74.14 108.472 179.067 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.452 ' HG1' ' HG2' ' A' ' 43' ' ' GLU . 29.8 m -88.77 99.33 12.28 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 107.589 -1.263 . . . . 73.21 107.589 177.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.553 HG11 HG12 ' A' ' 71' ' ' ILE . 47.0 t -91.84 103.64 14.75 Favored 'Isoleucine or valine' 0 C--O 1.239 0.545 0 N-CA-C 107.339 -1.356 . . . . 73.12 107.339 -178.201 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.576 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 43.1 mt-10 -85.44 101.66 12.8 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.136 -1.393 . . . . 73.52 108.759 -174.708 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.492 ' HB ' HG11 ' A' ' 11' ' ' VAL . 34.5 t -112.09 112.75 41.86 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 C-N-CA 123.985 0.914 . . . . 72.31 108.944 -175.026 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.634 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 42.1 tt0 -105.04 149.39 25.84 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.586 0.755 . . . . 74.5 111.164 -174.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -77.11 112.02 13.31 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.687 0.795 . . . . 74.23 109.188 173.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -121.21 111.69 17.71 Favored 'General case' 0 C--O 1.242 0.694 0 N-CA-C 107.891 -1.152 . . . . 73.52 107.891 171.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 75.09 -109.35 2.76 Favored Glycine 0 C--N 1.346 1.121 0 N-CA-C 110.778 -0.929 . . . . 55.11 110.778 -174.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -123.13 5.61 9.22 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.328 0.651 . . . . 62.22 109.822 176.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 67.9 p -110.54 148.0 33.02 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.382 0.673 . . . . 74.44 110.912 -176.16 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -96.17 112.02 23.89 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.185 0.994 . . . . 74.33 108.826 173.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.0 t -113.79 131.31 56.27 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 123.666 0.786 . . . . 73.3 110.211 -173.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.406 HG23 HG21 ' A' ' 59' ' ' VAL . 98.4 t -70.28 107.71 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 N-CA-C 109.247 -0.649 . . . . 73.4 109.247 174.264 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.634 ' HD3' ' HB3' ' A' ' 60' ' ' GLU . 30.6 mmmt -66.82 -52.83 39.19 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 115.23 -0.895 . . . . 74.31 109.498 176.288 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.5 ptt180 -162.71 164.9 26.2 Favored 'General case' 0 C--O 1.241 0.636 0 CA-C-N 114.508 -1.224 . . . . 71.3 109.779 -179.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.553 HG12 HG11 ' A' ' 57' ' ' VAL . 41.5 mt -121.93 107.69 20.44 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 C-N-CA 123.947 0.899 . . . . 60.32 108.606 175.527 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 36.4 m -93.22 103.82 16.05 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.6 0.76 . . . . 72.44 109.836 -176.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 36.9 ttt180 -79.43 133.89 36.55 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.012 0.525 . . . . 74.14 109.63 175.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 8.1 t -84.87 151.0 24.6 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 109.45 -0.574 . . . . 74.23 109.45 170.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 8.6 p -119.86 145.53 25.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 N-CA-C 108.604 -0.888 . . . . 75.23 108.604 177.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -65.25 -43.35 95.42 Favored Glycine 0 C--N 1.351 1.406 0 O-C-N 123.277 0.361 . . . . 42.24 112.431 -178.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.4 t -146.58 167.57 23.39 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.822 0.849 . . . . 71.23 109.765 179.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.4 pp -151.32 26.72 0.68 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.223 0.609 . . . . 71.03 111.277 -172.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -132.99 179.53 6.12 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.378 0.671 . . . . 72.35 112.368 -173.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 16.8 p80 -142.8 102.27 4.0 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 105.979 -1.86 . . . . 74.42 105.979 165.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 45.8 p-80 -64.37 140.58 58.88 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 116.033 -0.531 . . . . 74.44 111.649 -174.091 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 22.7 m170 -75.31 162.09 28.72 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 108.661 -0.866 . . . . 75.32 108.661 171.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 15.9 p-80 54.44 175.3 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.88 0 C-N-CA 126.112 1.765 . . . . 74.12 112.82 -169.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 37.5 m80 -132.47 149.92 52.25 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.474 0.71 . . . . 75.13 109.319 179.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 21.9 m-70 . . . . . 0 C--O 1.251 1.146 0 C-N-CA 123.564 0.746 . . . . 54.44 109.161 179.045 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.5 ttm . . . . . 0 N--CA 1.478 0.972 0 N-CA-C 109.561 -0.533 . . . . 74.42 109.561 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -60.76 110.96 0.91 Allowed 'Trans proline' 0 C--N 1.384 2.419 0 C-N-CA 122.391 2.06 . . . . 64.23 111.691 175.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 40.2 m -81.32 15.81 1.85 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 123.514 0.725 . . . . 72.23 111.726 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -49.59 -36.68 24.83 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.183 1.393 . . . . 60.22 112.748 -178.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -75.64 -36.61 60.13 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.545 0.738 . . . . 72.31 111.046 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -70.6 -22.97 62.49 Favored 'General case' 0 C--N 1.349 0.584 0 CA-C-N 115.161 -0.927 . . . . 74.44 110.376 174.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.512 ' O ' HG22 ' A' ' 11' ' ' VAL . 33.5 mm-40 -63.15 -49.76 73.05 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-O 118.988 -0.53 . . . . 75.01 110.02 177.333 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.46 -25.82 68.19 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 112.153 0.427 . . . . 75.12 112.153 178.646 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -63.65 -45.46 90.09 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.067 0.46 . . . . 75.34 109.832 172.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -69.04 -37.73 78.74 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 115.229 -0.896 . . . . 72.23 110.843 177.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.523 HG21 HD12 ' A' ' 40' ' ' ILE . 79.7 t -66.23 -50.68 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 123.806 0.842 . . . . 74.2 111.769 -174.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.494 ' HD3' HG23 ' A' ' 33' ' ' VAL . 34.3 mtmm -65.84 -32.86 74.62 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 123.236 0.335 . . . . 71.43 111.036 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.401 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 8.8 tt0 -65.89 -53.52 38.51 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 123.728 0.642 . . . . 74.2 110.285 177.082 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.47 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 78.9 t -59.2 -37.72 70.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 C-N-CA 123.03 0.532 . . . . 75.43 110.351 178.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.36 -44.77 86.59 Favored 'General case' 0 C--O 1.246 0.901 0 C-N-CA 123.613 0.765 . . . . 73.51 111.899 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -71.38 -31.24 67.08 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 116.396 -0.365 . . . . 73.53 110.591 -178.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.487 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 47.1 mt-10 -65.79 -39.86 91.36 Favored 'General case' 0 C--N 1.355 0.816 0 O-C-N 123.899 0.749 . . . . 74.03 110.686 179.766 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.47 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 67.8 mmtt -73.21 -28.2 62.04 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-O 120.81 0.338 . . . . 72.23 110.69 178.718 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.562 ' HB3' HD12 ' A' ' 46' ' ' LEU . 53.3 mt -70.2 -31.09 68.37 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.971 0.509 . . . . 75.2 111.069 169.472 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.1 mt -79.68 -17.95 52.49 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.891 0.876 . . . . 74.13 110.946 175.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 8.7 mm-40 -71.63 -41.05 69.29 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 109.736 -0.468 . . . . 74.0 109.736 172.278 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.417 ' NE2' HD22 ' A' ' 19' ' ' LEU . 42.0 mt-30 -76.54 -37.25 56.94 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 115.276 -0.875 . . . . 64.41 110.554 178.293 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.3 t -153.69 86.42 3.9 Favored Pre-proline 0 CA--C 1.551 1.006 0 C-N-CA 123.693 0.797 . . . . 62.04 110.779 -173.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo -78.37 -19.22 11.91 Favored 'Trans proline' 0 C--N 1.374 1.92 0 C-N-CA 122.505 2.137 . . . . 71.53 112.629 177.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.452 ' N ' HD21 ' A' ' 25' ' ' ASN . 0.7 OUTLIER -77.44 -19.68 55.67 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.68 0.792 . . . . 73.31 111.05 -175.24 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 31.4 m -100.13 141.58 32.76 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.178 0.591 . . . . 73.12 110.047 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -77.4 119.85 21.58 Favored 'General case' 0 C--O 1.243 0.755 0 C-N-CA 124.03 0.932 . . . . 72.41 109.546 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.9 t -98.32 112.4 30.33 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 N-CA-C 109.429 -0.582 . . . . 72.25 109.429 -178.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.442 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 30.7 mm-40 -94.93 174.42 7.1 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.353 1.061 . . . . 65.01 109.367 172.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 47.1 t -106.38 137.21 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 N-CA-C 108.961 -0.755 . . . . 73.31 108.961 169.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -102.7 -54.2 2.7 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.936 0.495 . . . . 74.25 110.19 179.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -153.88 147.84 25.55 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.994 0.918 . . . . 72.22 109.103 -176.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.518 HG11 HG22 ' A' ' 42' ' ' VAL . 88.1 t -121.51 118.83 57.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 N-CA-C 108.347 -0.983 . . . . 73.22 108.347 176.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -116.66 109.87 17.75 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.146 0.578 . . . . 73.04 109.743 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.526 ' HG2' HG12 ' A' ' 40' ' ' ILE . 2.8 tmtp? -83.65 117.25 23.06 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 107.138 -1.43 . . . . 75.12 107.138 178.664 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.0 89.88 2.81 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 108.983 -0.747 . . . . 71.41 108.983 -178.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.08 -111.46 3.94 Favored Glycine 0 C--N 1.344 1.023 0 O-C-N 123.612 0.57 . . . . 74.12 113.464 173.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -96.92 1.14 50.09 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.29 0.636 . . . . 73.42 111.388 177.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 23.7 m -131.24 107.88 9.3 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.327 0.651 . . . . 75.55 110.211 -176.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.526 HG12 ' HG2' ' A' ' 35' ' ' LYS . 33.7 mt -83.62 107.46 15.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 N-CA-C 108.497 -0.927 . . . . 71.45 108.497 172.089 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.524 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 98.1 mtt180 -86.36 95.27 9.6 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 109.008 -0.738 . . . . 75.11 109.008 176.097 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.518 HG22 HG11 ' A' ' 33' ' ' VAL . 58.5 t -86.73 113.48 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 N-CA-C 108.762 -0.829 . . . . 71.34 108.762 177.194 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.531 ' HG2' ' HG1' ' A' ' 56' ' ' THR . 35.3 mt-10 -86.98 104.42 16.28 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 124.087 0.955 . . . . 64.31 108.518 174.523 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.442 ' HB3' ' O ' ' A' ' 29' ' ' GLN . 4.8 mp -97.24 165.93 11.81 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 109.754 -0.461 . . . . 73.05 109.754 179.393 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -116.64 104.85 11.8 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.119 0.485 . . . . 72.42 109.983 -179.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.562 HD12 ' HB3' ' A' ' 19' ' ' LEU . 6.8 tt -107.42 129.39 54.94 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 106.927 -1.508 . . . . 73.4 106.927 177.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 55.8 mtm180 -99.95 102.17 13.48 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 108.48 -0.933 . . . . 71.12 108.48 -178.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 25.4 m -94.74 107.15 19.16 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.418 1.087 . . . . 62.41 109.686 -175.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 50.2 m-80 61.31 27.68 17.31 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 124.065 0.946 . . . . 74.43 112.06 179.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 97.65 -19.56 54.17 Favored Glycine 0 C--N 1.347 1.153 0 CA-C-N 116.119 -0.491 . . . . 54.53 112.98 -178.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 45.0 mtmt -74.09 124.43 26.28 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 109.288 -0.634 . . . . 74.55 109.288 177.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -82.35 110.86 17.88 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 108.562 -0.903 . . . . 75.53 108.562 178.104 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -126.26 145.38 50.43 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.17 0.588 . . . . 75.13 110.17 -177.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -108.32 129.98 55.21 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.207 0.603 . . . . 75.31 109.421 177.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.464 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 42.0 m-85 -113.91 118.93 35.58 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 108.911 -0.774 . . . . 73.14 108.911 179.085 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.531 ' HG1' ' HG2' ' A' ' 43' ' ' GLU . 31.9 m -83.57 101.45 11.47 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 108.948 -0.76 . . . . 74.44 108.948 176.192 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.445 HG12 HG12 ' A' ' 71' ' ' ILE . 48.0 t -94.91 110.38 23.81 Favored 'Isoleucine or valine' 0 C--O 1.239 0.514 0 CA-C-N 115.24 -0.891 . . . . 72.5 109.274 179.362 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.524 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 37.3 mt-10 -78.66 106.35 10.58 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.961 0.904 . . . . 70.1 109.089 177.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.542 HG23 HG22 ' A' ' 68' ' ' VAL . 41.6 t -111.65 114.36 46.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 N-CA-C 108.657 -0.868 . . . . 73.42 108.657 178.009 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -102.26 155.88 17.93 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.279 1.032 . . . . 64.0 110.781 -171.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.446 ' NH2' ' HA ' ' A' ' 64' ' ' ASN . 14.6 tpt180 -89.35 133.09 34.65 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.637 0.775 . . . . 75.15 110.146 -177.216 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -141.22 91.85 2.43 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 108.729 -0.841 . . . . 74.41 108.729 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.94 -102.78 1.03 Allowed Glycine 0 C--N 1.345 1.031 0 CA-C-N 116.095 -0.502 . . . . 44.52 112.707 179.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.446 ' HA ' ' NH2' ' A' ' 61' ' ' ARG . 19.8 m-80 -115.15 1.94 13.99 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.158 0.983 . . . . 73.14 111.174 177.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 71.5 p -115.51 166.63 11.68 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.812 0.845 . . . . 74.24 110.769 -178.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -117.65 136.37 53.37 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.116 0.966 . . . . 73.45 108.77 174.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 6.2 t -126.01 122.38 35.72 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.004 0.921 . . . . 72.42 110.048 -175.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.542 HG22 HG23 ' A' ' 59' ' ' VAL . 86.2 t -73.59 115.83 15.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 122.593 0.357 . . . . 72.12 110.203 178.23 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -74.57 -57.07 4.16 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.028 0.931 . . . . 73.44 110.441 178.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -160.47 148.2 16.2 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 116.174 -0.466 . . . . 75.03 110.683 -178.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.469 HD13 ' HB2' ' A' ' 18' ' ' LYS . 47.0 mt -105.44 106.78 21.16 Favored 'Isoleucine or valine' 0 C--O 1.24 0.596 0 N-CA-C 108.608 -0.886 . . . . 74.14 108.608 168.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 66.7 m -109.57 115.59 30.18 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.683 0.793 . . . . 72.24 108.92 176.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.464 ' HA ' ' HA ' ' A' ' 55' ' ' TYR . 49.4 ttp180 -68.38 145.66 53.94 Favored 'General case' 0 C--O 1.243 0.722 0 N-CA-C 109.473 -0.566 . . . . 74.24 109.473 176.283 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 14.6 t -62.3 134.95 57.2 Favored 'General case' 0 C--O 1.242 0.69 0 O-C-N 123.863 0.727 . . . . 72.11 110.081 -179.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 11.4 p -92.02 152.09 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 C-N-CA 123.194 0.598 . . . . 74.45 109.444 179.232 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -165.43 45.3 0.28 Allowed Glycine 0 C--N 1.339 0.71 0 N-CA-C 111.076 -0.81 . . . . 63.13 111.076 178.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.3 t -81.16 -173.8 4.52 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.622 0.769 . . . . 63.24 110.56 -177.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 96.5 mt -73.72 75.68 1.55 Allowed 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 121.424 0.63 . . . . 74.54 109.697 175.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -106.02 166.78 10.25 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.442 -0.799 . . . . 75.15 110.404 -174.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 -71.36 96.76 1.5 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.889 0.876 . . . . 73.33 111.114 -174.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -69.3 130.52 42.82 Favored 'General case' 0 C--O 1.242 0.663 0 C-N-CA 123.645 0.778 . . . . 74.35 109.094 176.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 86.3 t60 63.11 84.88 0.14 Allowed 'General case' 0 CA--C 1.549 0.926 0 O-C-N 124.567 1.167 . . . . 74.21 110.211 -169.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -126.33 13.92 7.7 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.26 1.024 . . . . 71.21 111.084 -175.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 26.2 p80 -149.46 157.54 43.38 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.413 0.685 . . . . 75.31 109.963 171.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 41.6 m-70 . . . . . 0 N--CA 1.477 0.894 0 C-N-CA 123.778 0.831 . . . . 75.33 110.11 175.633 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.6 mtt . . . . . 0 N--CA 1.483 1.192 0 CA-C-O 119.384 -0.341 . . . . 74.43 110.137 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -67.88 113.95 3.19 Favored 'Trans proline' 0 C--N 1.382 2.308 0 C-N-CA 122.866 2.378 . . . . 74.44 112.759 -176.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.6 t -81.35 178.91 8.09 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.527 0.731 . . . . 61.32 111.192 176.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -60.78 -24.17 65.58 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.172 0.589 . . . . 73.12 111.453 173.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -70.43 -42.57 71.38 Favored 'General case' 0 C--O 1.242 0.695 0 C-N-CA 123.171 0.588 . . . . 74.4 110.391 175.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.5 mm-40 -63.88 -21.12 66.31 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 112.744 0.646 . . . . 74.02 112.744 -176.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.553 ' O ' HG21 ' A' ' 11' ' ' VAL . 77.2 mt-10 -57.14 -56.89 15.95 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 124.085 0.866 . . . . 74.54 109.407 170.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -69.21 -32.21 71.32 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.257 0.623 . . . . 75.11 110.71 -176.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 29.8 mmt180 -55.45 -48.98 73.63 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.564 0.746 . . . . 62.2 110.122 174.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.537 ' O ' HG21 ' A' ' 14' ' ' VAL . 64.7 mt-30 -64.32 -45.38 88.15 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 114.26 -1.336 . . . . 70.31 111.16 178.172 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.594 HG23 HD12 ' A' ' 40' ' ' ILE . 59.0 t -61.53 -44.51 98.72 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 123.23 0.612 . . . . 73.33 111.899 -176.044 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt -65.19 -34.25 77.94 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.092 0.557 . . . . 75.42 110.24 178.27 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.479 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 8.5 tt0 -64.59 -51.7 61.33 Favored 'General case' 0 C--N 1.352 0.704 0 CA-C-N 115.656 -0.702 . . . . 72.5 110.418 175.192 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.537 HG21 ' O ' ' A' ' 10' ' ' GLN . 45.0 t -56.5 -46.75 82.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 C-N-CA 123.129 0.572 . . . . 74.12 109.578 -179.307 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.407 ' HB1' HD11 ' A' ' 44' ' ' LEU . . . -60.23 -47.5 85.72 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 114.896 -1.047 . . . . 62.41 112.29 -179.305 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -71.1 -35.4 71.8 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 122.822 0.449 . . . . 74.45 111.321 -175.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 36.4 mm-40 -69.09 -34.6 75.35 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.933 0.493 . . . . 75.51 111.021 -179.678 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.58 ' HB3' HD12 ' A' ' 71' ' ' ILE . 75.2 mmtt -68.16 -35.43 78.06 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.955 0.502 . . . . 70.31 111.063 176.102 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.547 ' HB3' HD12 ' A' ' 46' ' ' LEU . 29.8 mt -68.05 -31.84 71.78 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 115.518 -0.764 . . . . 74.33 111.291 174.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 84.9 mt -73.75 -26.11 60.5 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.927 0.891 . . . . 74.14 111.268 174.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 62.9 mm-40 -66.94 -40.68 87.63 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.652 0.381 . . . . 73.1 110.288 173.309 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -72.89 -40.92 65.19 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 123.892 0.745 . . . . 74.13 111.087 178.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.2 t -142.68 99.79 5.64 Favored Pre-proline 0 CA--C 1.548 0.867 0 CA-C-N 115.358 -0.837 . . . . 71.13 109.349 -175.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -79.61 -3.5 12.95 Favored 'Trans proline' 0 C--N 1.38 2.219 0 C-N-CA 122.598 2.198 . . . . 75.11 111.995 171.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -101.07 21.63 13.55 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.015 1.326 . . . . 75.34 110.269 -179.29 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 92.9 p -125.89 153.46 44.16 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 112.321 0.489 . . . . 72.12 112.321 -175.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -96.76 121.98 39.21 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 108.327 -0.99 . . . . 54.11 108.327 164.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 38.7 t -100.95 113.21 36.27 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 122.919 0.488 . . . . 73.12 109.739 177.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -96.74 159.4 14.95 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.225 1.01 . . . . 71.31 108.752 170.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.6 p -98.85 118.3 45.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 N-CA-C 108.413 -0.958 . . . . 72.04 108.413 170.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 21.8 tpt180 -85.78 -57.65 2.96 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 123.035 0.534 . . . . 75.21 110.429 -174.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.0 tpt180 -156.61 144.14 19.14 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.511 0.724 . . . . 75.31 109.753 -172.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 86.0 t -127.95 122.75 59.23 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 123.139 0.576 . . . . 72.32 110.282 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -106.8 129.53 54.65 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.641 1.176 . . . . 74.52 108.863 169.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.474 ' HG2' HG12 ' A' ' 40' ' ' ILE . 13.1 tmtt? -104.88 108.08 19.38 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 106.989 -1.486 . . . . 75.24 106.989 173.191 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -122.66 93.29 3.92 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.273 0.629 . . . . 73.41 110.173 -177.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 70.08 -98.13 0.62 Allowed Glycine 0 C--N 1.35 1.346 0 CA-C-N 115.497 -0.774 . . . . 73.22 112.343 178.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 47.5 m-80 -111.08 -29.25 7.96 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.052 0.541 . . . . 72.32 110.21 173.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 19.0 m -83.97 101.47 11.74 Favored 'General case' 0 C--N 1.352 0.69 0 CA-C-O 121.112 0.482 . . . . 74.4 110.204 -178.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.594 HD12 HG23 ' A' ' 11' ' ' VAL . 31.1 mt -87.95 112.69 23.95 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 CA-C-N 115.838 -0.619 . . . . 74.43 109.533 172.538 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.501 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 90.2 mtt180 -81.84 97.77 8.18 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 123.725 0.81 . . . . 75.42 109.645 174.346 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.44 HG11 ' HG ' ' A' ' 44' ' ' LEU . 61.2 t -91.3 107.42 18.69 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 N-CA-C 107.88 -1.156 . . . . 72.01 107.88 172.137 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -82.85 122.16 27.87 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 114.984 -1.007 . . . . 74.44 108.392 168.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.44 ' HG ' HG11 ' A' ' 42' ' ' VAL . 2.5 mp -116.41 153.64 31.7 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 109.358 -0.608 . . . . 74.31 109.358 -179.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.42 ' HG3' ' HD3' ' A' ' 52' ' ' LYS . 31.2 tt0 -111.42 103.89 12.29 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 109.301 -0.629 . . . . 74.12 109.301 175.594 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.547 HD12 ' HB3' ' A' ' 19' ' ' LEU . 7.3 tt -102.38 154.0 19.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.419 1.088 . . . . 74.34 109.444 -174.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 62.9 mtp180 -129.93 97.07 4.37 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.439 0.696 . . . . 73.44 110.64 177.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 86.2 m -80.25 102.46 9.5 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 108.95 -0.759 . . . . 64.45 108.95 176.036 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 62.49 26.43 15.73 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.38 0.672 . . . . 54.41 110.859 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.6 -20.27 51.09 Favored Glycine 0 C--N 1.354 1.565 0 CA-C-N 115.758 -0.655 . . . . 40.44 113.329 -177.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.528 ' HB3' ' HZ2' ' A' ' 51' ' ' LYS . 2.4 mmmp? -69.38 123.02 20.11 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 109.672 -0.492 . . . . 73.23 109.672 177.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.616 ' HZ1' ' HB3' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -88.82 112.99 23.89 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 108.814 -0.81 . . . . 74.24 108.814 -170.828 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -128.1 111.94 14.04 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.565 1.146 . . . . 65.34 109.061 178.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -78.78 133.68 37.07 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 109.067 -0.716 . . . . 75.52 109.067 173.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -114.41 171.72 7.45 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.431 0.692 . . . . 75.13 109.887 172.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 86.2 m -143.88 102.64 3.93 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 106.7 -1.593 . . . . 74.01 106.7 175.236 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.465 HG21 HG12 ' A' ' 71' ' ' ILE . 46.9 t -98.84 105.06 16.8 Favored 'Isoleucine or valine' 0 C--O 1.243 0.723 0 N-CA-C 107.608 -1.256 . . . . 74.32 107.608 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.501 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 28.1 mt-10 -80.52 102.3 9.65 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 115.442 -0.799 . . . . 74.2 109.433 178.562 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.542 ' HB ' HG13 ' A' ' 11' ' ' VAL . 25.9 t -105.71 115.67 47.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 C-N-CA 124.109 0.963 . . . . 72.41 108.711 -178.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.577 ' HB3' ' HE2' ' A' ' 69' ' ' LYS . 35.6 tt0 -102.25 154.76 18.73 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.72 0.808 . . . . 64.51 110.023 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 29.5 ttp180 -80.29 139.64 36.55 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 120.958 0.408 . . . . 75.54 111.733 177.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -127.09 103.18 7.3 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.89 1.276 . . . . 75.41 107.642 172.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.31 -110.76 3.52 Favored Glycine 0 CA--C 1.53 1.007 0 N-CA-C 111.533 -0.627 . . . . 71.14 111.533 -173.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -101.34 -21.62 14.8 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.01 0.524 . . . . 72.22 110.869 170.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.8 p -86.22 174.73 8.91 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.193 0.597 . . . . 72.53 110.53 -172.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 89.3 m95 -124.98 147.38 48.95 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.625 0.77 . . . . 73.52 108.936 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.2 t -145.91 135.35 23.07 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.078 0.551 . . . . 73.42 110.224 -170.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.576 HG23 ' HG3' ' A' ' 18' ' ' LYS . 70.5 t -85.08 129.76 37.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 123.62 0.768 . . . . 75.13 110.593 -176.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.577 ' HE2' ' HB3' ' A' ' 60' ' ' GLU . 74.8 mmtt -81.5 -50.39 9.46 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.916 -0.583 . . . . 62.21 109.871 175.229 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 26.9 ptt-85 -168.83 167.63 10.92 Favored 'General case' 0 C--O 1.245 0.84 0 CA-C-N 115.35 -0.841 . . . . 74.01 110.111 -177.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.58 HD12 ' HB3' ' A' ' 18' ' ' LYS . 59.5 mt -117.81 109.09 26.26 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 115.089 -0.96 . . . . 74.33 108.851 173.568 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 34.2 m -102.56 124.3 47.86 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 109.677 -0.49 . . . . 71.0 109.677 178.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 46.7 ttp180 -82.82 146.85 28.7 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 108.718 -0.845 . . . . 74.32 108.718 171.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.3 t -64.45 151.91 43.01 Favored 'General case' 0 C--O 1.247 0.929 0 C-N-CA 123.034 0.534 . . . . 73.23 110.368 172.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 7.6 p -64.03 110.74 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.042 0 CA-C-O 121.879 0.847 . . . . 63.3 108.792 173.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 155.6 150.2 5.53 Favored Glycine 0 N--CA 1.463 0.466 0 CA-C-N 114.042 -1.436 . . . . 74.44 109.891 -170.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 10.6 t 64.99 32.28 10.61 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.851 0.86 . . . . 74.4 110.521 -177.47 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -121.48 179.64 4.38 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.529 0.731 . . . . 64.1 110.359 -178.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -70.29 118.76 13.52 Favored 'General case' 0 C--O 1.241 0.64 0 CA-C-N 115.969 -0.56 . . . . 71.41 109.885 173.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 47.0 m80 -71.1 96.89 1.4 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 108.348 -0.982 . . . . 75.43 108.348 169.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 58.2 m80 -67.56 122.03 17.14 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.291 0.636 . . . . 74.51 110.613 -176.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 23.4 m170 -67.96 -41.68 82.06 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 108.64 -0.874 . . . . 75.01 108.64 175.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 29.7 p-80 -159.64 -170.54 2.95 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 114.167 -1.378 . . . . 75.24 108.835 176.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.9 p80 -161.34 111.28 1.65 Allowed 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.571 0.748 . . . . 61.13 109.055 174.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 25.6 p-80 . . . . . 0 C--O 1.253 1.244 0 C-N-CA 122.858 0.463 . . . . 74.42 110.853 -174.5 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.695 ' SD ' ' HA ' ' A' ' 7' ' ' GLU . 34.2 mtm . . . . . 0 N--CA 1.474 0.756 0 N-CA-C 108.842 -0.799 . . . . 75.5 108.842 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.452 ' HD2' ' HG2' ' A' ' 6' ' ' GLU . 34.8 Cg_endo -63.27 -38.86 41.46 Favored 'Trans proline' 0 C--N 1.372 1.801 0 C-N-CA 122.672 2.248 . . . . 75.24 112.954 177.243 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.6 m -138.63 -178.45 5.31 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.883 0.473 . . . . 70.5 111.166 -178.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.32 -35.98 82.65 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.904 0.882 . . . . 73.21 112.679 -169.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -64.36 -32.01 73.44 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 122.916 0.486 . . . . 74.43 111.153 -176.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.452 ' HG2' ' HD2' ' A' ' 2' ' ' PRO . 2.6 mp0 -71.84 -24.67 61.74 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 115.359 -0.837 . . . . 74.41 111.528 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.695 ' HA ' ' SD ' ' A' ' 1' ' ' MET . 51.0 mt-10 -56.43 -55.38 34.28 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 109.018 -0.734 . . . . 75.22 109.018 171.076 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.464 ' HG3' HG12 ' A' ' 33' ' ' VAL . 0.6 OUTLIER -55.91 -40.96 73.83 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 124.918 1.386 . . . . 74.32 110.368 -175.27 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 84.1 mtt-85 -55.25 -46.0 76.05 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.233 1.013 . . . . 75.03 110.66 177.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.428 ' O ' HG22 ' A' ' 14' ' ' VAL . 68.3 mm-40 -72.29 -50.89 23.61 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.423 -0.808 . . . . 75.23 110.739 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.501 HG21 ' O ' ' A' ' 7' ' ' GLU . 43.0 t -64.32 -35.98 75.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 124.156 0.982 . . . . 72.14 112.026 -167.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 47.2 mtmt -63.1 -41.83 99.45 Favored 'General case' 0 N--CA 1.484 1.237 0 O-C-N 123.277 0.361 . . . . 74.04 110.09 176.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.461 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 9.5 tt0 -67.3 -43.94 80.46 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 124.249 0.968 . . . . 72.34 110.315 178.554 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.477 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 98.9 t -60.58 -43.43 94.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.369 0.668 . . . . 75.14 109.682 178.297 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.06 -41.61 73.92 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 114.782 -1.099 . . . . 52.11 112.078 -174.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -67.13 -36.86 82.78 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 123.484 0.49 . . . . 74.23 110.114 -177.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.463 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 50.8 mt-10 -58.48 -46.01 87.52 Favored 'General case' 0 C--N 1.366 1.285 0 O-C-N 124.306 1.004 . . . . 74.42 109.788 177.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.477 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 31.9 mmmt -56.3 -43.76 79.24 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 124.671 1.232 . . . . 75.43 111.014 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 43.6 mt -72.08 -29.74 64.41 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 114.948 -1.023 . . . . 72.52 111.5 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.7 mt -76.03 -25.23 55.45 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.293 0.637 . . . . 73.44 111.108 176.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 17.4 mm-40 -67.42 -35.02 78.44 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-O 121.453 0.644 . . . . 74.31 109.911 175.276 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.422 HE22 HG21 ' A' ' 71' ' ' ILE . 48.0 mt-30 -88.77 -28.6 20.38 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 114.931 -1.031 . . . . 74.24 111.336 -179.152 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.487 ' HB3' HD11 ' A' ' 46' ' ' LEU . 32.4 t -150.93 84.92 5.26 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 123.248 0.619 . . . . 73.51 110.332 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -79.73 -6.41 14.33 Favored 'Trans proline' 0 C--N 1.376 2.019 0 C-N-CA 122.78 2.32 . . . . 75.43 112.946 176.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -90.11 7.49 37.62 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.655 0.782 . . . . 72.11 111.754 -178.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 39.9 t -133.25 158.52 42.7 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.375 0.67 . . . . 74.25 109.787 176.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -99.81 131.64 45.67 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.734 0.813 . . . . 74.2 108.948 177.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 40.9 t -98.46 129.92 48.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 C-N-CA 123.669 0.787 . . . . 74.34 109.679 -178.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -108.95 163.43 13.3 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.842 1.257 . . . . 73.31 109.526 177.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.8 p -90.99 119.06 37.45 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 N-CA-C 108.936 -0.765 . . . . 74.45 108.936 172.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 32.1 tpt180 -91.08 -58.37 2.49 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 109.195 -0.669 . . . . 62.11 109.195 178.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 -150.84 163.87 37.61 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.695 1.198 . . . . 75.43 109.578 173.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.513 HG13 HG22 ' A' ' 42' ' ' VAL . 47.0 t -131.96 115.85 28.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 N-CA-C 108.235 -1.024 . . . . 64.32 108.235 172.859 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 24.3 mp0 -101.23 124.98 47.77 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.363 0.665 . . . . 61.41 110.309 177.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.4 tptt -95.79 111.49 23.44 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.543 1.137 . . . . 73.2 109.341 175.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.26 72.2 0.98 Allowed 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 108.892 -0.781 . . . . 75.53 108.892 175.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 59.33 -104.35 0.53 Allowed Glycine 0 C--N 1.344 0.996 0 CA-C-N 115.353 -0.84 . . . . 55.21 113.121 179.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -75.55 -41.56 54.62 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.082 0.553 . . . . 75.25 110.503 -179.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.465 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 29.0 m -95.57 117.94 31.36 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.214 0.605 . . . . 72.4 111.144 -175.217 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 38.2 mt -98.04 116.8 41.64 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 123.558 0.743 . . . . 73.21 109.235 169.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 61.5 mtt180 -103.37 99.66 9.5 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 108.594 -0.891 . . . . 64.51 108.594 178.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.513 HG22 HG13 ' A' ' 33' ' ' VAL . 39.5 t -85.52 125.87 40.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 109.098 -0.704 . . . . 70.14 109.098 179.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -85.93 122.03 29.4 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 107.953 -1.129 . . . . 72.31 107.953 166.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.426 ' O ' ' HA ' ' A' ' 54' ' ' ASN . 4.2 mp -117.53 169.06 9.84 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.073 0.549 . . . . 60.21 109.643 178.052 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -134.19 103.0 5.58 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.224 0.535 . . . . 72.11 109.612 -174.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.487 HD11 ' HB3' ' A' ' 23' ' ' SER . 8.7 tt -110.36 134.79 51.95 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 106.831 -1.544 . . . . 72.44 106.831 178.308 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 74.7 mtt85 -101.74 96.97 7.43 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.463 0.649 . . . . 74.41 110.1 -175.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 37.5 m -81.74 104.56 12.22 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 114.996 -1.002 . . . . 71.24 108.616 -179.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 35.4 m-80 66.34 15.17 10.01 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 124.733 1.213 . . . . 62.45 111.075 -172.371 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.54 -18.81 54.66 Favored Glycine 0 C--N 1.355 1.618 0 CA-C-O 119.563 -0.576 . . . . 74.02 113.495 -172.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.18 136.14 51.64 Favored 'General case' 0 N--CA 1.488 1.45 0 CA-C-N 117.658 0.729 . . . . 73.22 110.723 178.264 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -77.81 100.16 6.2 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.39 0.676 . . . . 61.21 109.664 -175.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -105.66 112.87 26.11 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.887 0.875 . . . . 73.35 109.457 175.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.426 ' HA ' ' O ' ' A' ' 44' ' ' LEU . 17.0 m120 -91.65 118.4 30.61 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.128 0.571 . . . . 72.13 110.239 176.68 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -108.14 120.69 43.07 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 109.043 -0.725 . . . . 73.04 109.043 177.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 57.0 m -88.31 102.41 14.82 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.841 -0.8 . . . . 74.5 108.841 173.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 96.7 t -93.22 106.09 17.56 Favored 'Isoleucine or valine' 0 C--O 1.24 0.564 0 N-CA-C 108.371 -0.974 . . . . 72.24 108.371 179.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -86.17 104.28 15.59 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 114.491 -1.232 . . . . 73.21 108.811 -176.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 17.5 t -113.84 128.88 70.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 124.138 0.975 . . . . 65.55 108.7 -178.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.465 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 38.2 tt0 -112.33 150.02 31.61 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.089 0.555 . . . . 62.41 110.476 -176.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.4 tpp85 -73.08 128.34 35.19 Favored 'General case' 0 C--N 1.35 0.59 0 C-N-CA 123.912 0.885 . . . . 72.24 110.649 -177.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -122.95 90.44 3.29 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 107.911 -1.144 . . . . 71.42 107.911 172.029 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 72.2 -103.32 1.29 Allowed Glycine 0 C--N 1.348 1.225 0 CA-C-N 116.127 -0.488 . . . . 54.25 112.603 -177.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -119.83 2.9 11.1 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 124.125 0.97 . . . . 74.43 110.247 173.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 18.7 p -113.5 176.59 4.96 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.519 0.728 . . . . 74.22 109.705 176.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -118.72 153.36 34.52 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.051 0.941 . . . . 74.01 111.323 -174.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 4.9 t -137.33 117.41 13.41 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.217 1.007 . . . . 74.35 108.741 175.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.7 t -69.41 108.46 1.88 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.508 0 N-CA-C 109.254 -0.647 . . . . 74.45 109.254 176.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -67.49 -57.53 6.36 Favored 'General case' 0 C--O 1.237 0.432 0 O-C-N 123.983 0.802 . . . . 63.14 110.27 177.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -151.36 141.03 21.76 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.117 -0.492 . . . . 74.2 111.329 -172.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.422 HG21 HE22 ' A' ' 22' ' ' GLN . 34.1 mm -93.46 105.43 16.82 Favored 'Isoleucine or valine' 0 C--N 1.352 0.692 0 N-CA-C 107.884 -1.154 . . . . 75.3 107.884 165.079 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 74.4 m -96.49 131.17 43.36 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 108.724 -0.843 . . . . 75.11 108.724 173.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -98.31 148.51 23.58 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 108.731 -0.84 . . . . 73.25 108.731 172.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.4 t -62.16 122.82 16.54 Favored 'General case' 0 CA--C 1.551 1.017 0 N-CA-C 109.153 -0.684 . . . . 72.02 109.153 170.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 4.3 p -74.38 99.2 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 CA-C-O 121.721 0.772 . . . . 73.32 109.515 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -100.96 -120.38 4.61 Favored Glycine 0 C--N 1.341 0.808 0 N-CA-C 110.583 -1.007 . . . . 73.02 110.583 178.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 63.8 m -72.33 97.09 1.96 Allowed 'General case' 0 C--O 1.242 0.696 0 N-CA-C 109.182 -0.673 . . . . 70.53 109.182 171.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.4 tt -144.83 106.26 4.23 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 107.131 -1.433 . . . . 53.22 107.131 -177.173 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.6 mp0 -66.85 92.29 0.22 Allowed 'General case' 0 C--O 1.242 0.675 0 N-CA-C 107.773 -1.195 . . . . 63.55 107.773 171.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -66.07 103.62 0.99 Allowed 'General case' 0 C--N 1.346 0.429 0 N-CA-C 109.213 -0.662 . . . . 73.21 109.213 178.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 8.5 t-160 -68.22 146.04 53.73 Favored 'General case' 0 C--O 1.243 0.748 0 N-CA-C 108.174 -1.047 . . . . 52.31 108.174 174.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 11.5 t-80 -49.99 -39.52 41.35 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.203 1.001 . . . . 72.32 111.612 -176.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 9.1 p80 -162.61 126.59 3.03 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 124.077 0.86 . . . . 75.03 108.843 170.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -83.53 -32.95 25.62 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 109.186 -0.672 . . . . 74.14 109.186 168.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 61.3 m80 . . . . . 0 C--O 1.247 0.932 0 C-N-CA 123.676 0.791 . . . . 62.31 110.727 -179.591 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.6 ttm . . . . . 0 N--CA 1.48 1.043 0 N-CA-C 109.376 -0.602 . . . . 71.52 109.376 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.82 -11.91 31.71 Favored 'Trans proline' 0 C--N 1.379 2.159 0 C-N-CA 123.294 2.663 . . . . 63.12 114.089 -176.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.4 m 67.65 31.43 6.04 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 125.115 1.366 . . . . 74.31 110.86 -177.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -68.42 -26.48 65.55 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.861 1.264 . . . . 74.14 112.1 -175.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -88.13 -28.63 21.14 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 121.89 -0.507 . . . . 72.51 110.286 176.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.475 ' HA ' ' HD3' ' A' ' 9' ' ' ARG . 37.1 tt0 -79.98 -25.48 40.33 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 116.508 -0.315 . . . . 73.3 111.759 -178.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.595 ' HG3' ' HD2' ' A' ' 8' ' ' LYS . 9.7 pt-20 -60.27 -33.95 73.04 Favored 'General case' 0 C--O 1.211 -0.958 0 CA-C-O 119.451 -0.309 . . . . 71.22 110.48 178.512 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.595 ' HD2' ' HG3' ' A' ' 7' ' ' GLU . 12.3 mptt -64.45 -43.86 92.96 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.16 0.584 . . . . 73.41 110.067 175.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.475 ' HD3' ' HA ' ' A' ' 6' ' ' GLU . 72.2 mtp180 -57.92 -43.26 86.12 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.117 0.967 . . . . 73.4 110.392 177.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.422 ' O ' HG22 ' A' ' 14' ' ' VAL . 50.8 mt-30 -64.71 -46.41 82.45 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 114.537 -1.211 . . . . 73.2 110.839 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.581 HG11 ' HB ' ' A' ' 59' ' ' VAL . 41.4 t -63.07 -39.7 86.21 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 124.793 1.237 . . . . 72.14 111.927 -177.148 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.474 ' HE2' ' HA ' ' A' ' 9' ' ' ARG . 49.8 mtmt -64.06 -37.5 87.67 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.54 0.736 . . . . 64.2 110.397 178.491 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -71.41 -43.67 66.35 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-N 115.552 -0.749 . . . . 75.34 110.554 179.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.422 HG22 ' O ' ' A' ' 10' ' ' GLN . 87.7 t -58.94 -42.3 85.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 124.036 0.934 . . . . 64.41 110.299 176.41 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.34 -48.93 68.66 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 114.825 -1.079 . . . . 75.1 111.777 -177.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.412 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 19.8 ptmt -67.09 -28.55 68.27 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 115.755 -0.657 . . . . 64.44 111.051 -175.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -60.56 -43.83 96.84 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.429 0.691 . . . . 75.32 111.478 176.031 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.485 ' HG3' HG23 ' A' ' 68' ' ' VAL . 59.3 mmtt -70.54 -26.7 63.69 Favored 'General case' 0 N--CA 1.481 1.108 0 O-C-N 123.708 0.63 . . . . 74.12 110.147 -178.579 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.692 ' HB3' HD11 ' A' ' 46' ' ' LEU . 21.8 mt -75.23 -32.06 61.04 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 115.107 -0.951 . . . . 75.44 111.22 173.481 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 95.4 mt -73.35 -21.79 60.45 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.425 0.69 . . . . 75.2 111.287 175.638 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -66.67 -36.18 81.92 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-O 121.544 0.687 . . . . 75.45 110.09 173.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.426 HE21 ' HA ' ' A' ' 19' ' ' LEU . 45.8 mt-30 -81.29 -41.51 22.02 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 114.82 -1.082 . . . . 72.41 111.069 -179.723 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.4 t -153.96 89.45 3.41 Favored Pre-proline 0 CA--C 1.554 1.114 0 C-N-CA 123.524 0.73 . . . . 73.32 109.364 -174.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.33 -26.73 10.13 Favored 'Trans proline' 0 C--N 1.375 1.943 0 C-N-CA 122.809 2.339 . . . . 73.53 113.067 177.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -68.9 -25.98 64.87 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.633 0.773 . . . . 74.12 111.298 -174.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 35.0 p -84.11 138.36 33.07 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.781 0.832 . . . . 63.5 110.845 177.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.504 ' HB3' ' NH2' ' A' ' 47' ' ' ARG . 2.7 tpmt? -82.31 111.78 18.69 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 108.432 -0.951 . . . . 64.41 108.432 175.165 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 41.0 t -97.45 120.05 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 124.062 0.945 . . . . 72.45 109.512 -173.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.437 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 84.5 mm-40 -107.27 172.18 6.97 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.261 1.024 . . . . 64.15 109.219 174.173 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.448 HG23 ' HB3' ' A' ' 12' ' ' LYS . 57.6 t -102.55 123.05 55.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 108.627 -0.879 . . . . 73.34 108.627 176.056 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.5 tpt180 -92.13 -48.13 6.88 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.152 0.581 . . . . 74.45 110.684 -174.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -149.26 145.04 26.88 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.572 1.149 . . . . 73.13 107.932 -173.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.428 HG23 HG11 ' A' ' 42' ' ' VAL . 86.3 t -125.17 130.6 73.03 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 N-CA-C 108.519 -0.919 . . . . 72.43 108.519 173.161 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -120.43 108.28 13.92 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.15 0.98 . . . . 63.33 109.415 178.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.6 tmtt? -97.16 111.97 23.97 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 108.312 -0.995 . . . . 74.13 108.312 -177.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -126.0 86.69 2.56 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.46 0.704 . . . . 72.33 109.48 -176.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 60.56 -80.77 0.01 OUTLIER Glycine 0 C--N 1.353 1.489 0 N-CA-C 115.223 0.849 . . . . 70.23 115.223 172.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -103.68 -45.81 4.7 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.181 0.993 . . . . 72.13 110.359 -177.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.557 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 8.9 m -100.33 133.69 44.37 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.231 0.613 . . . . 62.2 111.134 -175.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.571 HD12 HG22 ' A' ' 11' ' ' VAL . 32.7 mt -110.5 109.01 26.88 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.9 0 C-N-CA 123.481 0.712 . . . . 75.01 109.395 174.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 39.3 mtm180 -86.19 96.77 10.03 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 109.24 -0.652 . . . . 72.34 109.24 176.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.449 HG22 HG12 ' A' ' 11' ' ' VAL . 60.7 t -90.82 117.01 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 123.143 0.577 . . . . 75.42 109.47 176.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.554 ' HG2' ' HG1' ' A' ' 56' ' ' THR . 46.5 mt-10 -91.73 115.28 27.92 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.462 1.105 . . . . 70.33 108.83 174.598 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.437 ' HB3' ' O ' ' A' ' 29' ' ' GLN . 4.1 mp -111.1 159.48 17.78 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 122.025 -0.422 . . . . 64.25 110.375 -176.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -106.48 107.19 18.07 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 109.184 -0.673 . . . . 72.32 109.184 178.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.692 HD11 ' HB3' ' A' ' 19' ' ' LEU . 7.1 tt -111.19 125.47 53.83 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 106.918 -1.512 . . . . 74.24 106.918 175.547 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.504 ' NH2' ' HB3' ' A' ' 27' ' ' LYS . 43.4 mtm180 -103.24 95.6 6.21 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 109.282 -0.636 . . . . 70.23 109.282 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 56.9 m -70.99 101.34 2.16 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.503 1.121 . . . . 75.41 110.227 -176.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 19.1 m120 60.86 26.19 16.07 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.189 0.995 . . . . 74.0 111.942 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 99.22 2.82 56.8 Favored Glycine 0 C--N 1.352 1.45 0 CA-C-O 119.545 -0.586 . . . . 54.22 113.7 -179.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -103.22 124.14 48.06 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-N 117.686 0.743 . . . . 70.12 109.831 174.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -78.91 119.34 21.95 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 122.884 0.474 . . . . 75.23 110.448 -175.24 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -134.53 122.31 22.23 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.911 1.284 . . . . 64.35 108.276 175.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -88.03 140.2 29.74 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 109.787 -0.449 . . . . 70.44 109.787 176.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -120.46 121.58 38.8 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.333 0.653 . . . . 73.32 109.562 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.554 ' HG1' ' HG2' ' A' ' 43' ' ' GLU . 24.6 m -86.97 103.72 15.61 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 108.17 -1.048 . . . . 73.1 108.17 175.786 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.402 HG12 HD11 ' A' ' 71' ' ' ILE . 58.7 t -102.3 114.81 42.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 124.218 1.007 . . . . 63.43 109.096 -179.181 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -89.02 101.98 14.63 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 109.063 -0.717 . . . . 73.0 109.063 179.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.581 ' HB ' HG11 ' A' ' 11' ' ' VAL . 22.2 t -105.11 109.99 29.48 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 C-N-CA 123.551 0.74 . . . . 64.33 109.273 178.055 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.557 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 34.8 tt0 -102.07 144.62 30.43 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.765 1.226 . . . . 73.24 111.039 -172.043 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 7.5 tpp180 -69.73 105.81 2.87 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.643 0.777 . . . . 73.11 109.574 176.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 52.2 tp60 -97.17 86.42 3.94 Favored 'General case' 0 C--O 1.242 0.707 0 N-CA-C 108.58 -0.896 . . . . 72.3 108.58 176.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 68.71 -101.02 0.73 Allowed Glycine 0 C--N 1.348 1.2 0 CA-C-N 115.18 -0.918 . . . . 54.13 111.168 -175.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -100.37 -33.05 10.54 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.67 1.188 . . . . 60.42 110.25 176.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 24.8 p -86.32 177.38 7.49 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.878 0.871 . . . . 64.52 110.814 -178.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -111.78 158.94 18.77 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.059 0.944 . . . . 73.41 109.038 172.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.5 t -145.99 137.65 24.98 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.675 0.79 . . . . 73.42 109.13 179.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.485 HG23 ' HG3' ' A' ' 18' ' ' LYS . 96.7 t -86.03 115.12 26.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 N-CA-C 108.94 -0.763 . . . . 74.3 108.94 176.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -74.89 -49.74 19.32 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 124.297 1.039 . . . . 61.33 110.25 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.1 ptp85 -157.89 159.92 37.1 Favored 'General case' 0 C--O 1.244 0.792 0 CA-C-N 115.228 -0.896 . . . . 73.03 111.277 177.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.402 HD11 HG12 ' A' ' 57' ' ' VAL . 36.4 mm -114.41 122.98 69.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 N-CA-C 106.508 -1.664 . . . . 75.11 106.508 167.281 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 11.7 t -126.98 133.93 50.48 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 109.116 -0.698 . . . . 75.2 109.116 171.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 22.1 ttm180 -91.92 140.33 29.78 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.382 -0.97 . . . . 75.52 108.382 176.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.3 t -69.87 122.56 19.5 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 108.533 -0.914 . . . . 64.41 108.533 171.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 7.6 p -69.15 112.44 3.93 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.961 0 CA-C-O 121.566 0.698 . . . . 74.3 110.057 -176.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -134.16 -38.36 0.21 Allowed Glycine 0 C--N 1.341 0.827 0 N-CA-C 110.112 -1.195 . . . . 73.22 110.112 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 30.0 t -142.18 114.81 8.51 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 108.188 -1.042 . . . . 64.22 108.188 172.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -66.72 162.71 20.7 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.42 0.688 . . . . 75.11 110.291 175.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -66.19 84.25 0.09 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.064 0.546 . . . . 72.52 111.059 177.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 59.4 t60 -78.24 86.57 4.34 Favored 'General case' 0 C--O 1.244 0.795 0 N-CA-C 106.747 -1.575 . . . . 61.33 106.747 168.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 -67.65 133.0 48.58 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 115.374 -0.83 . . . . 71.12 109.251 -178.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 11.5 m170 -65.48 -34.83 79.19 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.144 0.978 . . . . 74.25 111.506 -168.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 48.4 m80 55.38 77.77 0.21 Allowed 'General case' 0 N--CA 1.478 0.931 0 O-C-N 124.281 0.988 . . . . 74.14 110.728 178.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -131.36 155.08 47.86 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.956 -0.566 . . . . 74.21 109.933 -175.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 28.4 p-80 . . . . . 0 C--O 1.25 1.105 0 C-N-CA 123.838 0.855 . . . . 73.23 110.314 -177.786 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.433 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.2 mpt? . . . . . 0 N--CA 1.486 1.334 0 N-CA-C 109.435 -0.58 . . . . 73.24 109.435 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -69.19 -30.5 24.84 Favored 'Trans proline' 0 C--N 1.381 2.269 0 C-N-CA 123.138 2.559 . . . . 75.03 113.675 -175.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.437 ' O ' ' HG2' ' A' ' 7' ' ' GLU . 49.0 m 62.3 21.94 12.85 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.846 1.259 . . . . 62.11 112.609 -175.507 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -57.89 -52.37 65.76 Favored 'General case' 0 C--N 1.359 1.021 0 C-N-CA 123.32 0.648 . . . . 75.13 111.526 -174.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -60.13 -42.62 95.19 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 115.356 -0.838 . . . . 75.25 110.715 -178.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -59.39 -33.94 71.83 Favored 'General case' 0 C--N 1.349 0.586 0 C-N-CA 124.422 1.089 . . . . 72.02 111.428 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.513 ' O ' HG22 ' A' ' 11' ' ' VAL . 6.4 mm-40 -58.03 -55.53 33.7 Favored 'General case' 0 C--N 1.347 0.475 0 O-C-N 123.634 0.584 . . . . 73.52 110.13 176.772 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -33.37 75.81 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 123.099 0.25 . . . . 73.25 111.309 179.775 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 20.5 mtp180 -65.16 -33.74 76.72 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 122.871 0.468 . . . . 74.42 110.786 178.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -68.62 -49.63 57.74 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.362 0.665 . . . . 71.42 109.694 171.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.58 HG12 ' HB ' ' A' ' 59' ' ' VAL . 89.9 t -64.16 -46.3 93.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 123.543 0.737 . . . . 71.1 112.562 -171.057 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.455 ' HD3' HG23 ' A' ' 33' ' ' VAL . 50.5 mtmt -64.97 -36.04 83.13 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.364 0.666 . . . . 73.5 110.715 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.557 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 8.8 tt0 -66.43 -55.63 14.83 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.022 -0.99 . . . . 73.12 109.661 177.517 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.498 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 75.5 t -52.9 -43.16 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 123.439 0.695 . . . . 72.23 110.086 177.033 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.87 -45.06 91.05 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-N 115.065 -0.97 . . . . 75.34 111.787 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.401 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 19.6 ptmt -74.48 -28.47 61.03 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.259 -0.428 . . . . 60.51 110.873 -178.776 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.557 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 19.2 mm-40 -65.83 -35.78 81.63 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 123.43 0.456 . . . . 73.24 110.144 176.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.54 ' HG3' HG23 ' A' ' 68' ' ' VAL . 28.6 mmmt -73.37 -31.0 63.67 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 115.564 -0.744 . . . . 72.24 110.934 178.321 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.803 ' HB3' HD11 ' A' ' 46' ' ' LEU . 26.6 mt -74.42 -26.68 60.22 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.589 -0.732 . . . . 74.25 111.136 172.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 88.3 mt -77.85 -18.94 55.72 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.24 0.616 . . . . 64.4 110.576 172.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -69.79 -38.38 76.63 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.966 0.506 . . . . 74.2 110.515 170.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -76.38 -35.44 58.64 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 115.649 -0.705 . . . . 74.23 110.569 176.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 37.9 t -158.48 96.1 1.84 Allowed Pre-proline 0 CA--C 1.552 1.057 0 C-N-CA 123.259 0.624 . . . . 60.22 110.168 -176.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -77.96 -15.57 14.77 Favored 'Trans proline' 0 C--N 1.38 2.203 0 C-N-CA 123.057 2.505 . . . . 74.12 113.262 -177.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -88.84 -20.65 24.37 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.871 0.868 . . . . 63.44 111.422 -174.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 83.6 p -82.36 158.71 23.26 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.381 0.672 . . . . 74.12 112.744 -172.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -81.06 120.79 25.26 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.624 -0.717 . . . . 74.43 109.476 167.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 39.6 t -110.52 113.91 45.58 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 N-CA-C 108.254 -1.017 . . . . 75.23 108.254 172.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 56.1 tp60 -108.99 145.51 35.4 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.223 1.009 . . . . 73.35 108.743 177.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.2 p -71.26 127.78 33.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.951 0 N-CA-C 109.457 -0.572 . . . . 73.03 109.457 172.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.4 tpt180 -95.54 -62.11 1.35 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 122.657 0.383 . . . . 74.44 110.076 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -151.97 161.44 42.63 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.146 0.979 . . . . 72.31 109.733 -177.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.455 HG23 ' HD3' ' A' ' 12' ' ' LYS . 88.7 t -137.86 119.09 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 C-N-CA 123.911 0.885 . . . . 74.2 109.841 -176.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.678 ' HB3' HE21 ' A' ' 36' ' ' GLN . 21.1 mp0 -120.74 112.65 19.11 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.108 0.963 . . . . 71.13 109.611 -178.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.533 ' HG2' HG12 ' A' ' 40' ' ' ILE . 12.6 tmtt? -83.18 105.17 13.94 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 108.112 -1.069 . . . . 71.43 108.112 178.329 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.678 HE21 ' HB3' ' A' ' 34' ' ' GLN . 84.6 mm-40 -117.45 93.32 4.12 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.725 0.81 . . . . 71.51 110.167 -173.166 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 74.53 -95.68 0.89 Allowed Glycine 0 C--N 1.346 1.102 0 CA-C-N 116.193 -0.458 . . . . 54.53 112.432 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -118.68 -17.82 9.15 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.584 0.753 . . . . 73.03 109.583 172.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.466 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 11.9 m -93.38 106.03 18.04 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.192 0.997 . . . . 74.01 110.353 -177.348 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.551 HD12 HG21 ' A' ' 11' ' ' VAL . 52.7 mt -80.98 108.29 14.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 N-CA-C 108.968 -0.753 . . . . 74.51 108.968 170.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.543 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 80.8 mtt180 -80.82 100.69 8.94 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.21 -0.905 . . . . 75.13 109.076 174.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 35.9 t -92.38 111.12 23.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 108.356 -0.979 . . . . 75.22 108.356 173.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -77.84 126.02 30.22 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 108.801 -0.814 . . . . 75.12 108.801 167.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -129.78 156.32 44.52 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 108.941 -0.763 . . . . 72.43 108.941 174.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -116.95 106.86 13.88 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.444 1.098 . . . . 74.1 108.652 -174.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.803 HD11 ' HB3' ' A' ' 19' ' ' LEU . 6.9 tt -107.15 140.96 39.17 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 125.172 1.389 . . . . 72.35 108.532 -173.499 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.493 ' HA ' ' HA ' ' A' ' 52' ' ' LYS . 29.9 mtm180 -102.09 95.33 6.27 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 109.49 -0.559 . . . . 75.24 109.49 178.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 7.1 m -84.52 100.75 11.57 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.497 0.719 . . . . 74.41 110.269 -177.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 61.1 t30 67.74 18.47 9.78 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 124.156 0.982 . . . . 72.13 111.456 172.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 99.9 -12.38 60.79 Favored Glycine 0 C--N 1.348 1.245 0 CA-C-N 116.283 -0.417 . . . . 75.21 112.863 -175.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 27.4 mmmt -91.06 121.29 32.73 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 108.567 -0.901 . . . . 75.22 108.567 167.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.493 ' HA ' ' HA ' ' A' ' 47' ' ' ARG . 39.1 ttpt -99.38 121.53 41.24 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 109.56 -0.533 . . . . 72.33 109.56 -174.414 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -125.3 149.37 48.13 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 123.647 0.779 . . . . 75.43 110.86 -174.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -90.04 118.75 29.83 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.407 -0.815 . . . . 75.52 109.894 176.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -109.14 167.22 10.26 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.929 0.892 . . . . 65.35 109.506 173.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 42.7 m -144.62 105.08 4.11 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 108.538 -0.912 . . . . 75.22 108.538 177.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 42.4 t -92.71 104.98 16.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.621 0 N-CA-C 108.234 -1.024 . . . . 73.02 108.234 179.045 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.543 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 32.1 mt-10 -78.35 106.57 10.37 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 113.88 -1.509 . . . . 73.43 108.58 179.273 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.58 ' HB ' HG12 ' A' ' 11' ' ' VAL . 47.0 t -115.3 113.19 42.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 C-N-CA 123.684 0.794 . . . . 74.11 109.518 -176.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.531 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 32.2 tt0 -102.93 149.37 24.59 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.884 0.874 . . . . 62.13 110.483 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -67.97 129.98 41.58 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.112 0.565 . . . . 74.42 111.05 179.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 56.8 tp60 -119.05 79.86 1.46 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.88 0.872 . . . . 75.12 109.005 175.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 70.46 -100.75 0.83 Allowed Glycine 0 CA--C 1.531 1.065 0 CA-C-N 115.671 -0.695 . . . . 73.13 112.514 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -99.13 -28.0 13.56 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.844 0.857 . . . . 71.42 110.667 -179.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.9 t -100.82 172.13 7.25 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.522 0.729 . . . . 74.01 110.462 -178.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 94.3 m95 -107.52 151.52 25.47 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.485 0.714 . . . . 73.1 109.23 173.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 14.7 t -137.46 149.09 46.58 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.854 0.462 . . . . 72.2 110.631 -179.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.54 HG23 ' HG3' ' A' ' 18' ' ' LYS . 67.2 t -92.46 111.34 24.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 C-N-CA 123.671 0.788 . . . . 75.55 109.639 -175.661 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.531 ' HD3' ' HB3' ' A' ' 60' ' ' GLU . 30.7 mmmt -69.85 -57.84 4.59 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.751 0.82 . . . . 75.44 110.42 177.247 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.0 tpt180 -160.39 135.93 8.16 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.934 -0.575 . . . . 74.43 111.222 -178.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.531 HD13 ' HB3' ' A' ' 18' ' ' LYS . 56.8 mt -89.11 103.84 14.37 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 N-CA-C 107.388 -1.338 . . . . 74.32 107.388 164.226 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 86.0 m -99.89 114.68 28.07 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.488 0.715 . . . . 63.23 109.558 178.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 65.9 ttt180 -72.77 144.9 47.4 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 108.885 -0.783 . . . . 75.24 108.885 169.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 12.2 t -68.46 141.26 55.68 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 108.782 -0.821 . . . . 63.43 108.782 171.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 24.7 t -69.13 100.28 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 N-CA-C 108.643 -0.873 . . . . 73.23 108.643 -176.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -69.99 -57.64 6.85 Favored Glycine 0 C--N 1.347 1.158 0 N-CA-C 111.373 -0.691 . . . . 53.12 111.373 177.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 70.3 m -154.77 157.96 38.77 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 124.067 0.947 . . . . 74.23 109.421 173.565 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -155.58 171.22 20.31 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.21 1.004 . . . . 70.04 108.86 175.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -137.23 142.58 42.05 Favored 'General case' 0 C--O 1.242 0.684 0 C-N-CA 123.453 0.701 . . . . 75.01 109.474 -178.828 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 14.8 p-80 -76.46 166.51 23.32 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 109.796 -0.446 . . . . 74.51 109.796 177.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -80.09 140.07 36.61 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 109.296 -0.631 . . . . 63.12 109.296 172.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 34.1 p80 -61.07 -18.07 55.92 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 124.131 0.972 . . . . 75.53 112.834 -171.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 19.8 t-80 -129.56 103.4 6.85 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 108.532 -0.914 . . . . 74.41 108.532 176.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 44.5 t60 -129.54 103.04 6.65 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 122.824 0.45 . . . . 73.3 110.08 179.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 76.7 t60 . . . . . 0 C--O 1.251 1.182 0 N-CA-C 107.808 -1.182 . . . . 74.34 107.808 169.229 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.567 ' HA ' ' HD3' ' A' ' 9' ' ' ARG . 34.0 tt0 . . . . . 0 N--CA 1.47 0.555 0 N-CA-C 110.816 -0.068 . . . . 75.24 110.816 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.46 ' O ' HG23 ' A' ' 11' ' ' VAL . 30.2 mm-40 -64.83 -38.2 90.19 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 119.316 -0.373 . . . . 55.21 110.819 178.598 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -59.78 -45.94 90.74 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 109.503 -0.555 . . . . 65.21 109.503 174.126 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.567 ' HD3' ' HA ' ' A' ' 6' ' ' GLU . 74.4 mtp180 -54.36 -42.12 69.94 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 124.144 0.902 . . . . 70.21 111.082 -178.787 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -70.84 -52.62 19.19 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.754 0.821 . . . . 74.04 111.306 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.68 HG21 HD12 ' A' ' 40' ' ' ILE . 96.3 t -64.79 -44.99 96.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 124.015 0.926 . . . . 74.12 112.15 -171.89 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.446 ' HD2' HG11 ' A' ' 30' ' ' VAL . 47.4 mtmt -68.28 -31.63 71.23 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 123.77 0.669 . . . . 64.52 110.704 -179.4 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.479 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 60.6 tt0 -69.51 -46.35 66.76 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 123.753 0.658 . . . . 71.24 110.033 176.122 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.487 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 68.8 t -58.67 -45.24 90.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 123.032 0.533 . . . . 61.1 109.631 175.872 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.508 ' HB1' HD11 ' A' ' 44' ' ' LEU . . . -60.61 -48.43 81.8 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.614 1.165 . . . . 71.02 111.741 -176.856 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.41 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 20.8 ptmt -67.74 -42.56 81.67 Favored 'General case' 0 C--N 1.351 0.639 0 O-C-N 123.63 0.581 . . . . 75.21 110.47 -178.393 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 63.3 mm-40 -63.64 -34.67 78.37 Favored 'General case' 0 C--N 1.357 0.932 0 O-C-N 123.62 0.575 . . . . 75.14 111.023 -177.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.495 ' HB3' HD11 ' A' ' 71' ' ' ILE . 65.9 mmtt -64.05 -40.93 97.38 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 123.654 0.596 . . . . 72.44 111.067 176.589 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.564 HD12 HG11 ' A' ' 28' ' ' VAL . 64.7 mt -70.41 -29.71 66.4 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 116.088 -0.506 . . . . 53.55 111.288 176.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 89.7 mt -77.65 -23.67 49.65 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.835 0.854 . . . . 63.32 110.556 175.85 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -74.04 -39.51 63.48 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.43 0.692 . . . . 75.35 109.543 172.633 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 95.6 mt-30 -73.38 -31.12 63.73 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 115.784 -0.643 . . . . 73.14 111.426 178.458 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.8 t -153.65 87.97 3.69 Favored Pre-proline 0 CA--C 1.56 1.362 0 C-N-CA 122.496 0.318 . . . . 52.11 110.307 -176.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -68.03 -17.13 45.96 Favored 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 123.658 2.905 . . . . 64.22 114.812 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -79.81 -17.46 53.29 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-O 121.03 0.443 . . . . 64.33 111.062 178.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 37.1 m -91.65 147.98 22.6 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.683 0.793 . . . . 73.41 111.443 -177.493 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -109.39 118.78 37.56 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 108.655 -0.868 . . . . 73.12 108.655 172.54 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.564 HG11 HD12 ' A' ' 19' ' ' LEU . 36.6 t -100.26 144.05 13.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 C-N-CA 124.02 0.928 . . . . 74.14 110.265 -175.72 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -132.58 147.96 52.36 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.342 1.057 . . . . 70.35 108.488 172.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.446 HG11 ' HD2' ' A' ' 12' ' ' LYS . 57.6 t -67.16 137.04 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.125 0.57 . . . . 74.33 109.975 177.01 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.8 tpt85 -115.7 -39.34 3.53 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.374 0.269 . . . . 73.41 110.965 -173.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.591 ' HB3' ' HB2' ' A' ' 43' ' ' GLU . 0.1 OUTLIER -167.8 144.46 4.17 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 108.551 -0.907 . . . . 54.3 108.551 -174.208 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.544 HG22 HG13 ' A' ' 42' ' ' VAL . 89.8 t -135.08 139.29 47.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 N-CA-C 108.838 -0.801 . . . . 65.22 108.838 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -135.35 113.69 11.47 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.902 0.881 . . . . 73.21 110.711 177.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.504 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 23.9 tptm -81.31 107.7 14.31 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 108.65 -0.871 . . . . 71.33 108.65 172.86 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -121.93 81.96 1.89 Allowed 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 108.681 -0.859 . . . . 71.24 108.681 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.504 ' O ' ' HE2' ' A' ' 35' ' ' LYS . . . 63.91 -125.65 32.98 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 111.521 -0.632 . . . . 44.12 111.521 -173.709 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -70.91 -30.47 66.81 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-N 117.524 0.662 . . . . 74.45 111.2 174.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 24.7 m -94.81 110.21 22.1 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 123.245 0.618 . . . . 73.43 111.798 -169.377 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.68 HD12 HG21 ' A' ' 11' ' ' VAL . 41.1 mt -95.57 113.5 30.1 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 123.799 0.84 . . . . 73.2 110.479 174.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 24.8 mtp-105 -87.88 101.56 13.85 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.286 0.634 . . . . 65.3 109.295 173.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.544 HG13 HG22 ' A' ' 33' ' ' VAL . 48.9 t -97.85 108.36 21.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 N-CA-C 108.763 -0.829 . . . . 73.41 108.763 176.319 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.591 ' HB2' ' HB3' ' A' ' 32' ' ' ARG . 51.9 mp0 -75.0 129.29 37.39 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 108.867 -0.79 . . . . 71.12 108.867 165.479 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.508 HD11 ' HB1' ' A' ' 15' ' ' ALA . 3.5 mp -122.72 168.29 12.4 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.878 -0.786 . . . . 72.14 108.878 172.948 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -126.41 108.63 11.39 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.297 -1.001 . . . . 74.4 108.297 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.416 HD12 ' HB3' ' A' ' 19' ' ' LEU . 6.8 tt -95.92 119.32 34.2 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.377 1.071 . . . . 75.41 108.112 -177.481 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 84.9 mtm180 . . . . . 0 N--CA 1.479 0.989 0 C-N-CA 123.498 0.719 . . . . 74.23 109.914 -174.929 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt . . . . . 0 CA--C 1.534 0.352 0 N-CA-C 107.223 -1.399 . . . . 75.42 107.223 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -104.48 114.82 29.31 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.222 0.609 . . . . 70.24 109.556 -174.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -75.39 117.98 17.78 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.645 -0.872 . . . . 65.14 108.645 171.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -105.92 170.46 7.89 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.646 0.778 . . . . 74.04 109.716 177.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 26.8 m -145.09 102.16 3.71 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 108.028 -1.101 . . . . 72.44 108.028 173.089 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.42 HG11 ' HA ' ' A' ' 15' ' ' ALA . 61.1 t -93.0 102.92 14.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 N-CA-C 107.019 -1.474 . . . . 71.13 107.019 178.362 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -89.19 105.3 17.7 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 114.298 -1.319 . . . . 70.42 108.14 -177.09 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 45.4 t -100.04 152.26 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 125.041 1.337 . . . . 73.54 109.52 -176.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -130.0 144.99 51.63 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.133 0.973 . . . . 70.3 110.207 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.8 tpt180 -81.33 113.04 19.16 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.774 0.83 . . . . 75.31 109.566 175.042 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 -120.42 100.63 7.27 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 107.998 -1.112 . . . . 72.25 107.998 170.61 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 72.49 -112.19 3.89 Favored Glycine 0 C--N 1.348 1.2 0 N-CA-C 111.368 -0.693 . . . . 45.25 111.368 -175.066 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -106.54 -16.13 14.61 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.571 0.748 . . . . 73.5 110.572 174.306 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 42.2 p -93.37 149.23 21.39 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 122.993 0.517 . . . . 75.35 111.166 -172.361 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -103.25 116.22 32.04 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.226 1.01 . . . . 75.05 109.905 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.1 t -108.49 145.22 35.04 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.762 0.825 . . . . 54.45 110.435 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.47 HG21 ' HG3' ' A' ' 18' ' ' LYS . 88.7 t -86.23 113.02 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 O-C-N 121.856 -0.527 . . . . 71.13 109.908 179.465 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.5 mmmp? -66.1 -47.47 74.09 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.913 0.885 . . . . 55.31 110.603 173.488 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -161.95 154.29 19.59 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.501 -0.772 . . . . 71.33 110.75 -178.398 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.495 HD11 ' HB3' ' A' ' 18' ' ' LYS . 80.3 mt -113.57 107.24 22.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 107.119 -1.438 . . . . 50.33 107.119 166.587 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 27.6 m -92.28 144.18 25.65 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.662 0.785 . . . . 72.32 109.063 178.112 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -116.18 148.48 40.32 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 107.21 -1.404 . . . . 74.51 107.21 170.443 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.1 t . . . . . 0 CA--C 1.549 0.929 0 C-N-CA 123.452 0.701 . . . . 32.34 109.902 174.355 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 . . . . . 0 N--CA 1.474 0.743 0 N-CA-C 110.662 -0.125 . . . . 73.41 110.662 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.552 ' O ' HG23 ' A' ' 11' ' ' VAL . 67.8 mm-40 -59.06 -47.31 85.69 Favored 'General case' 0 C--N 1.356 0.875 0 CA-C-O 118.745 -0.645 . . . . 72.12 110.696 -178.028 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.72 -35.46 72.71 Favored 'General case' 0 C--N 1.364 1.199 0 O-C-N 123.671 0.607 . . . . 43.11 111.022 177.279 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 20.9 mtm180 -65.55 -32.82 74.62 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 122.627 0.371 . . . . 73.42 110.902 178.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.409 ' O ' HG23 ' A' ' 14' ' ' VAL . 41.6 mt-30 -74.36 -38.48 63.19 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 122.99 0.516 . . . . 75.15 110.555 174.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.644 HG21 HD12 ' A' ' 40' ' ' ILE . 58.5 t -70.11 -44.29 78.28 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 C-N-CA 123.493 0.717 . . . . 62.03 111.288 -176.718 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.467 ' HD3' HG21 ' A' ' 33' ' ' VAL . 45.7 mtmt -63.03 -37.35 86.82 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.911 0.884 . . . . 62.11 110.02 177.733 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.452 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.3 tt0 -63.28 -55.65 22.98 Favored 'General case' 0 C--N 1.353 0.729 0 O-C-N 124.408 1.067 . . . . 71.14 110.072 177.672 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.527 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 95.8 t -55.84 -44.24 76.99 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 O-C-N 123.515 0.51 . . . . 61.12 109.941 178.468 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.435 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -60.24 -45.78 92.07 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 124.561 1.144 . . . . 62.24 112.156 -177.647 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -74.47 -31.98 62.42 Favored 'General case' 0 C--N 1.349 0.582 0 CA-C-N 116.02 -0.536 . . . . 62.45 110.68 -177.218 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 7.3 mm-40 -64.81 -38.39 90.82 Favored 'General case' 0 C--N 1.352 0.692 0 O-C-N 123.807 0.692 . . . . 75.31 110.014 176.086 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.527 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 29.0 mmmt -58.94 -49.89 76.14 Favored 'General case' 0 C--N 1.362 1.124 0 O-C-N 123.72 0.637 . . . . 72.52 110.617 176.915 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.645 ' HB3' HD12 ' A' ' 46' ' ' LEU . 53.1 mt -66.29 -29.26 69.44 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.227 -0.897 . . . . 63.45 112.194 -179.101 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.9 mt -78.86 -27.5 44.08 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.219 0.607 . . . . 54.34 111.078 176.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.445 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 52.7 mt-10 -70.94 -42.87 69.25 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 109.719 -0.474 . . . . 63.43 109.719 174.282 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -68.64 -41.85 78.83 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 115.168 -0.924 . . . . 74.23 111.001 178.445 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.2 t -145.58 91.51 5.72 Favored Pre-proline 0 CA--C 1.552 1.054 0 CA-C-N 115.662 -0.699 . . . . 72.12 109.453 -177.507 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -79.63 -2.85 12.52 Favored 'Trans proline' 0 C--N 1.378 2.102 0 C-N-CA 122.927 2.418 . . . . 55.24 112.15 174.435 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -95.26 13.93 23.96 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.399 1.08 . . . . 74.32 110.673 -178.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 60.1 p -135.21 148.87 49.77 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.048 0.539 . . . . 64.24 110.871 -175.555 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.402 ' HE2' ' HA ' ' A' ' 27' ' ' LYS . 11.1 mmpt? -90.3 114.63 26.73 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-O 121.256 0.551 . . . . 74.44 109.925 175.215 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 87.5 t -99.86 124.69 53.43 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 CA-C-N 114.29 -1.323 . . . . 72.23 109.252 -178.62 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -112.85 167.06 10.81 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.225 1.41 . . . . 63.24 108.157 174.454 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.41 HG21 ' HB3' ' A' ' 12' ' ' LYS . 87.6 t -104.96 110.92 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 N-CA-C 107.929 -1.137 . . . . 50.33 107.929 169.75 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -81.89 -43.82 17.65 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 122.767 0.427 . . . . 62.13 111.379 -171.505 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -162.78 146.21 11.14 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 108.168 -1.049 . . . . 70.23 108.168 -176.362 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.544 HG13 HG22 ' A' ' 42' ' ' VAL . 40.0 t -118.34 141.22 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 N-CA-C 108.892 -0.781 . . . . 53.14 108.892 177.175 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 21.3 tp60 -135.83 112.74 10.28 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 122.988 0.515 . . . . 73.02 110.241 177.245 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.413 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 3.2 tmtp? -86.11 117.48 24.97 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 108.349 -0.982 . . . . 74.23 108.349 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -129.23 75.89 1.68 Allowed 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.464 0.706 . . . . 70.4 110.083 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.413 ' O ' ' HE2' ' A' ' 35' ' ' LYS . . . 67.27 -96.99 0.35 Allowed Glycine 0 C--N 1.35 1.335 0 CA-C-N 115.274 -0.875 . . . . 74.31 113.971 173.525 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.705 ' HB3' ' HG3' ' A' ' 60' ' ' GLU . 16.7 m120 -80.24 -52.58 7.56 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 109.254 -0.647 . . . . 53.12 109.254 173.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 19.8 m -94.84 110.3 22.19 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 114.919 -1.037 . . . . 64.43 110.601 -168.293 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.644 HD12 HG21 ' A' ' 11' ' ' VAL . 41.9 mt -87.86 107.99 17.99 Favored 'Isoleucine or valine' 0 C--O 1.24 0.568 0 N-CA-C 108.541 -0.911 . . . . 71.52 108.541 169.563 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.56 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 86.8 mtt180 -82.97 96.54 8.35 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 109.0 -0.741 . . . . 61.1 109.0 174.717 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.544 HG22 HG13 ' A' ' 33' ' ' VAL . 40.7 t -88.29 114.11 26.31 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 107.832 -1.173 . . . . 74.05 107.832 174.895 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -85.94 107.16 17.6 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.907 0.883 . . . . 74.35 109.411 174.216 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.2 mp -99.43 170.51 8.57 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.689 0.796 . . . . 74.03 110.761 178.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -130.19 104.04 7.07 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.98 0.912 . . . . 62.45 109.37 -177.018 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.645 HD12 ' HB3' ' A' ' 19' ' ' LEU . 9.6 tt -104.58 143.96 32.35 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 108.432 -0.951 . . . . 74.52 108.432 -177.052 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 56.1 mtt85 . . . . . 0 N--CA 1.479 0.98 0 C-N-CA 122.923 0.489 . . . . 61.23 110.814 -177.198 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 33.9 ttpt . . . . . 0 CA--C 1.546 0.804 0 N-CA-C 111.734 0.272 . . . . 75.21 111.734 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -118.67 113.01 20.54 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 107.826 -1.176 . . . . 73.43 107.826 170.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -81.21 126.07 31.07 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.241 0.616 . . . . 73.41 110.031 177.487 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -113.06 118.73 35.6 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.198 0.599 . . . . 70.51 109.706 178.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 30.7 m -86.33 102.7 14.24 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.978 0.911 . . . . 63.13 109.093 174.349 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.465 HG13 HG12 ' A' ' 71' ' ' ILE . 56.0 t -91.54 105.91 17.06 Favored 'Isoleucine or valine' 0 C--O 1.243 0.733 0 N-CA-C 108.633 -0.877 . . . . 72.41 108.633 179.137 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.56 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 24.7 mt-10 -83.84 102.04 12.07 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 125.237 1.415 . . . . 52.32 108.985 -178.015 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.552 HG22 HG22 ' A' ' 68' ' ' VAL . 18.1 t -110.43 123.59 66.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 123.394 0.678 . . . . 70.11 109.373 -177.445 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.705 ' HG3' ' HB3' ' A' ' 38' ' ' ASN . 39.7 tt0 -102.97 142.97 33.17 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.123 0.969 . . . . 75.42 110.723 -175.753 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -79.96 111.72 16.57 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 123.584 0.754 . . . . 72.44 109.103 171.692 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 15.6 mm-40 -116.15 99.26 7.11 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 108.235 -1.024 . . . . 74.15 108.235 171.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.45 -106.07 1.69 Allowed Glycine 0 C--N 1.345 1.053 0 N-CA-C 111.115 -0.794 . . . . 62.44 111.115 -173.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -112.65 -17.57 12.56 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.014 0.926 . . . . 63.14 110.656 174.231 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 81.0 p -88.36 128.83 35.51 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 122.965 0.506 . . . . 74.45 110.279 -174.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.8 m95 -82.24 131.97 35.23 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.519 0.728 . . . . 73.51 109.287 172.513 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 8.8 t -132.67 121.12 22.66 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 123.442 0.697 . . . . 73.2 109.785 -175.635 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.552 HG22 HG22 ' A' ' 59' ' ' VAL . 97.7 t -74.32 104.02 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 123.605 0.762 . . . . 65.52 110.075 -179.244 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -70.0 -50.75 38.43 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.592 0.757 . . . . 74.52 110.754 -177.642 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 21.4 tpt180 -158.75 147.34 18.5 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.508 -0.769 . . . . 70.24 110.14 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.465 HG12 HG13 ' A' ' 57' ' ' VAL . 65.8 mt -110.55 105.73 19.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 N-CA-C 107.909 -1.145 . . . . 44.44 107.909 172.628 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 59.9 m -98.93 107.12 19.48 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.786 0.834 . . . . 60.02 110.302 -178.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 30.6 ttp180 -75.01 151.01 38.79 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.516 0.726 . . . . 72.33 110.439 175.061 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 15.1 t . . . . . 0 CA--C 1.549 0.923 0 C-N-CA 123.399 0.68 . . . . 71.12 109.576 171.709 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 . . . . . 0 N--CA 1.485 1.314 0 CA-C-O 121.16 0.505 . . . . 64.5 111.442 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.56 ' O ' HG23 ' A' ' 11' ' ' VAL . 12.2 pt-20 -59.39 -37.56 78.29 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 115.651 -0.704 . . . . 64.11 110.808 176.74 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.596 ' HG3' HG11 ' A' ' 33' ' ' VAL . 0.3 OUTLIER -54.84 -39.13 68.26 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 123.627 0.771 . . . . 73.55 111.142 177.925 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.8 mmm180 -62.39 -42.56 99.52 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.708 0.803 . . . . 75.33 109.93 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.447 ' O ' HG23 ' A' ' 14' ' ' VAL . 45.7 mm-40 -66.84 -43.08 84.62 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 114.729 -1.123 . . . . 74.33 110.937 177.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.601 HG21 HD12 ' A' ' 40' ' ' ILE . 63.7 t -67.89 -43.22 86.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 123.854 0.862 . . . . 72.14 111.655 -174.201 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -63.51 -31.91 73.21 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.029 0.531 . . . . 72.41 110.488 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.438 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 59.6 tt0 -66.71 -52.95 38.74 Favored 'General case' 0 C--N 1.349 0.554 0 O-C-N 123.847 0.717 . . . . 71.1 110.165 174.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 10' ' ' GLN . 66.1 t -59.71 -30.79 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 123.624 0.77 . . . . 64.03 110.804 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.511 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -76.17 -47.12 25.34 Favored 'General case' 0 C--O 1.248 0.992 0 C-N-CA 123.977 0.911 . . . . 62.24 111.992 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -70.59 -33.64 71.29 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 116.054 -0.521 . . . . 64.42 111.514 -172.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 23.1 mm-40 -65.92 -36.99 84.9 Favored 'General case' 0 C--N 1.353 0.753 0 O-C-N 123.789 0.68 . . . . 74.2 110.887 178.791 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.595 ' HG3' HG21 ' A' ' 68' ' ' VAL . 68.4 mmtt -60.66 -42.89 97.94 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 123.613 0.571 . . . . 62.25 111.303 176.502 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 51.4 mt -72.45 -30.23 64.4 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 115.756 -0.656 . . . . 70.13 111.859 178.355 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 68.8 mt -70.34 -27.38 64.31 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.204 0.602 . . . . 75.44 111.308 174.289 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 50.5 mt-10 -70.12 -35.05 73.83 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 120.947 0.403 . . . . 73.31 110.479 174.177 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -83.08 -24.98 32.45 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 115.61 -0.723 . . . . 72.03 111.664 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.0 t -158.56 93.61 1.95 Allowed Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 123.448 0.699 . . . . 45.54 109.394 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_endo -82.06 -9.45 11.76 Favored 'Trans proline' 0 C--N 1.373 1.828 0 C-N-CA 123.142 2.561 . . . . 74.11 113.683 -178.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -85.82 -6.18 59.14 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.263 0.625 . . . . 61.41 111.447 -178.525 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 64.6 p -114.37 140.54 48.57 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.198 0.999 . . . . 74.1 111.078 -175.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -80.15 127.61 32.52 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.903 -0.777 . . . . 55.5 108.903 171.091 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.558 HG22 HD12 ' A' ' 46' ' ' LEU . 39.6 t -98.71 112.67 31.4 Favored 'Isoleucine or valine' 0 C--O 1.239 0.532 0 O-C-N 123.535 0.522 . . . . 65.52 109.669 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -99.13 172.98 7.04 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.618 0.767 . . . . 71.42 109.394 175.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.7 p -98.3 132.87 42.47 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 N-CA-C 108.923 -0.769 . . . . 65.41 108.923 171.582 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.8 tpt180 -88.95 -47.44 8.14 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.399 0.68 . . . . 73.25 109.304 173.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.6 mtt180 -165.02 157.78 16.24 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.319 1.048 . . . . 64.13 109.755 175.536 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.596 HG11 ' HG3' ' A' ' 8' ' ' LYS . 73.0 t -116.49 110.27 30.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 N-CA-C 108.692 -0.855 . . . . 63.51 108.692 175.353 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -100.99 109.8 21.76 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.172 0.589 . . . . 75.13 109.435 -177.31 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.3 mmtt -79.69 136.29 36.75 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.915 0.886 . . . . 74.44 109.475 178.471 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -150.6 67.07 0.94 Allowed 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 107.928 -1.138 . . . . 73.13 107.928 -178.571 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 67.86 -135.24 30.28 Favored Glycine 0 C--N 1.349 1.277 0 CA-C-N 115.293 -0.867 . . . . 75.52 111.857 -173.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -76.45 -1.14 25.64 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.05 0.54 . . . . 33.32 111.856 176.073 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 55.1 m -99.84 141.66 32.36 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.462 0.705 . . . . 71.12 109.161 169.491 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.601 HD12 HG21 ' A' ' 11' ' ' VAL . 59.9 mt -129.79 117.4 41.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 C-N-CA 123.477 0.711 . . . . 53.32 109.222 171.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.424 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 9.8 mtp180 -81.91 97.9 8.28 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 108.684 -0.858 . . . . 74.22 108.684 169.031 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.6 t -80.71 114.19 21.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 N-CA-C 107.973 -1.121 . . . . 74.33 107.973 174.11 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -86.16 117.57 25.07 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 106.632 -1.618 . . . . 54.43 106.632 169.655 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.0 mp -111.92 169.84 8.56 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.054 0.454 . . . . 61.2 110.117 -179.073 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -141.58 107.64 5.19 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.696 0.76 . . . . 61.14 109.16 179.391 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.558 HD12 HG22 ' A' ' 28' ' ' VAL . 3.0 tt -113.21 135.52 53.73 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.522 1.529 . . . . 72.31 108.492 -173.131 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 66.5 mtp180 . . . . . 0 N--CA 1.486 1.358 0 CA-C-N 117.87 0.305 . . . . 72.21 111.463 -178.746 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt . . . . . 0 N--CA 1.471 0.596 0 CA-C-O 121.546 0.688 . . . . 71.52 109.655 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -108.62 125.55 51.99 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 115.332 -0.849 . . . . 75.33 109.872 -175.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -78.72 146.06 34.14 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.199 0.523 . . . . 63.02 109.709 171.138 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -132.71 171.12 14.29 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.666 0.786 . . . . 74.1 109.507 177.756 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.682 ' HB ' ' HB ' ' A' ' 72' ' ' THR . 79.3 m -142.23 104.22 4.41 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 108.174 -1.047 . . . . 55.32 108.174 177.483 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.511 HG11 ' HA ' ' A' ' 15' ' ' ALA . 99.1 t -99.54 104.82 16.56 Favored 'Isoleucine or valine' 0 C--O 1.239 0.545 0 N-CA-C 107.726 -1.213 . . . . 72.14 107.726 174.281 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.424 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 31.5 mt-10 -82.59 100.21 10.01 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 114.007 -1.451 . . . . 61.52 108.618 -177.432 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.1 t -100.95 151.17 5.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 124.19 0.996 . . . . 74.42 109.132 -177.298 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -145.31 135.62 24.04 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 108.753 -0.832 . . . . 71.21 108.753 -175.054 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 31.1 ttp180 -80.29 133.27 35.95 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.152 0.581 . . . . 73.13 111.998 -172.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 64.3 mm-40 -121.08 109.24 14.8 Favored 'General case' 0 C--O 1.242 0.697 0 N-CA-C 107.515 -1.291 . . . . 73.04 107.515 175.571 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 67.88 -106.13 1.61 Allowed Glycine 0 C--N 1.345 1.029 0 N-CA-C 110.719 -0.953 . . . . 73.33 110.719 -171.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 54.3 t30 -110.41 -27.28 9.11 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.804 0.842 . . . . 50.44 110.022 172.293 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 33.9 p -77.75 172.52 13.29 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.163 0.585 . . . . 73.13 110.675 -177.117 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 89.0 m95 -125.76 146.68 49.67 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.376 0.67 . . . . 71.14 110.371 -175.81 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 6.1 t -137.75 144.07 41.48 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 122.892 0.477 . . . . 64.15 110.092 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.595 HG21 ' HG3' ' A' ' 18' ' ' LYS . 76.3 t -82.96 118.67 31.04 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 123.072 0.549 . . . . 61.21 109.86 177.494 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -88.62 -30.99 18.8 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 116.096 -0.502 . . . . 75.4 111.509 177.597 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 65.5 ttt-85 -158.66 137.17 10.94 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 120.527 0.204 . . . . 63.22 111.292 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 73.3 mt -103.02 131.18 51.88 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 N-CA-C 107.975 -1.121 . . . . 64.15 107.975 168.151 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.682 ' HB ' ' HB ' ' A' ' 56' ' ' THR . 27.8 m -128.1 150.2 50.07 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.203 1.001 . . . . 43.13 108.976 -177.455 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 27.4 ttp180 -126.41 145.37 50.49 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.079 0.952 . . . . 75.34 108.634 175.015 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.7 t . . . . . 0 CA--C 1.546 0.808 0 CA-C-O 121.111 0.481 . . . . 54.21 110.053 177.088 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 . . . . . 0 CA--C 1.53 0.2 0 N-CA-C 111.495 0.183 . . . . 63.21 111.495 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.554 ' O ' HG23 ' A' ' 11' ' ' VAL . 7.5 mm-40 -52.09 -52.41 51.46 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 124.295 0.997 . . . . 64.2 110.568 178.245 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.1 -43.2 96.1 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.17 -0.923 . . . . 74.32 109.811 -177.293 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 25.3 mtm180 -59.78 -35.12 73.99 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.6 0.76 . . . . 71.35 111.708 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.468 ' O ' HG23 ' A' ' 14' ' ' VAL . 58.5 mt-30 -75.12 -55.1 6.07 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.406 0.682 . . . . 72.21 110.511 179.085 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.586 HG13 ' HB ' ' A' ' 59' ' ' VAL . 42.8 t -62.73 -46.01 97.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 123.726 0.81 . . . . 74.23 111.766 -170.792 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -66.42 -33.4 75.63 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.135 0.574 . . . . 24.51 110.882 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -70.76 -44.34 66.94 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 123.603 0.564 . . . . 64.13 110.214 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.488 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 88.9 t -58.05 -50.35 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 N-CA-C 109.051 -0.722 . . . . 74.41 109.051 175.202 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.494 ' HB1' HD11 ' A' ' 44' ' ' LEU . . . -58.53 -45.91 87.89 Favored 'General case' 0 C--O 1.244 0.786 0 CA-C-N 114.368 -1.287 . . . . 72.41 112.292 -175.099 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.416 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 22.4 ptmt -69.45 -37.02 77.17 Favored 'General case' 0 C--N 1.353 0.749 0 O-C-N 123.525 0.515 . . . . 74.05 110.46 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.41 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 40.0 mt-10 -64.38 -34.03 77.23 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.319 0.647 . . . . 72.51 111.067 179.424 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.502 ' HG3' HG21 ' A' ' 68' ' ' VAL . 30.5 mmmt -69.87 -35.49 74.72 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.06 0.457 . . . . 64.54 110.504 178.088 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.759 ' HB3' HD12 ' A' ' 46' ' ' LEU . 41.7 mt -72.61 -23.57 60.96 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 115.257 -0.883 . . . . 74.31 111.299 173.302 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 96.4 mt -85.18 -17.66 36.47 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.986 0.914 . . . . 75.44 111.462 175.235 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 15.1 mm-40 -71.91 -44.13 64.2 Favored 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 108.467 -0.938 . . . . 72.25 108.467 169.063 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -78.52 -32.76 48.21 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 114.732 -1.122 . . . . 64.02 111.322 -177.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.547 ' HB2' HD11 ' A' ' 46' ' ' LEU . 49.0 m -154.83 80.9 4.38 Favored Pre-proline 0 CA--C 1.562 1.408 0 C-N-CA 123.854 0.861 . . . . 61.45 110.368 -173.584 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.2 -27.07 17.09 Favored 'Trans proline' 0 C--N 1.375 1.957 0 C-N-CA 122.722 2.282 . . . . 72.21 113.308 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -83.84 -9.67 58.59 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.343 0.657 . . . . 73.53 111.488 -177.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 38.0 m -89.34 145.98 25.0 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.274 0.63 . . . . 64.33 111.188 -177.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.424 ' HE2' ' HA ' ' A' ' 27' ' ' LYS . 0.6 OUTLIER -89.29 109.18 20.1 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.6 0.76 . . . . 71.43 109.641 -178.855 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 64.5 t -97.61 122.0 48.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 C-N-CA 124.05 0.94 . . . . 63.42 109.249 -175.339 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -101.37 148.44 25.15 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.492 1.117 . . . . 73.22 108.686 177.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 59.0 t -78.58 106.98 10.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 N-CA-C 107.68 -1.23 . . . . 64.35 107.68 166.38 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.7 tpt180 -82.12 -61.68 1.84 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 122.609 0.364 . . . . 73.02 110.021 -177.341 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -147.47 170.05 18.22 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 125.177 1.391 . . . . 62.31 109.359 179.064 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.412 HG13 HG22 ' A' ' 42' ' ' VAL . 61.4 t -135.57 114.85 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 N-CA-C 108.134 -1.062 . . . . 70.22 108.134 173.218 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -107.88 110.81 22.67 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.534 0.734 . . . . 70.31 109.219 -179.203 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.464 ' HG2' HG12 ' A' ' 40' ' ' ILE . 2.5 tmtp? -92.43 108.74 20.19 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 108.602 -0.888 . . . . 71.14 108.602 -176.848 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 18.9 mm100 -121.31 83.26 2.05 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.492 0.717 . . . . 72.53 110.026 -178.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.77 -108.96 2.66 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 115.206 -0.907 . . . . 72.23 112.889 178.118 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -93.34 -27.51 16.73 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.334 0.653 . . . . 70.5 110.2 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 32.6 m -93.11 97.72 10.85 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 123.6 0.76 . . . . 65.52 110.489 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.464 HG12 ' HG2' ' A' ' 35' ' ' LYS . 36.0 mt -86.19 107.45 16.58 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 N-CA-C 108.549 -0.908 . . . . 73.54 108.549 173.105 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 52.0 mtt85 -89.0 96.66 10.82 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.395 1.078 . . . . 70.24 109.797 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.423 HG23 HG12 ' A' ' 11' ' ' VAL . 57.3 t -80.82 124.45 38.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 108.575 -0.898 . . . . 72.03 108.575 175.357 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -90.94 124.09 34.94 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 107.966 -1.124 . . . . 72.15 107.966 174.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.494 HD11 ' HB1' ' A' ' 15' ' ' ALA . 2.0 mp -128.43 150.01 50.31 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 109.156 -0.683 . . . . 74.22 109.156 -179.326 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -108.81 106.04 15.88 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.376 0.608 . . . . 60.44 109.567 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.759 HD12 ' HB3' ' A' ' 19' ' ' LEU . 9.3 tt -92.68 109.11 20.53 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 107.527 -1.286 . . . . 75.31 107.527 -177.032 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 . . . . . 0 CA--C 1.539 0.553 0 C-N-CA 124.371 1.068 . . . . 71.34 109.59 -175.592 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.0 tttt . . . . . 0 C--O 1.237 0.419 0 N-CA-C 106.32 -1.733 . . . . 70.45 106.32 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -114.19 141.46 47.5 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.66 0.784 . . . . 54.24 109.641 -171.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -111.96 117.0 31.51 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 108.877 -0.786 . . . . 54.15 108.877 174.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -108.1 120.6 42.8 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.65 1.18 . . . . 75.03 110.095 178.1 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 32.9 m -88.94 101.44 14.07 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 108.775 -0.824 . . . . 73.15 108.775 168.275 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.545 HG22 HG23 ' A' ' 71' ' ' ILE . 43.0 t -91.88 106.62 17.91 Favored 'Isoleucine or valine' 0 C--O 1.243 0.746 0 N-CA-C 108.554 -0.906 . . . . 54.02 108.554 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -77.38 102.91 7.02 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 114.258 -1.337 . . . . 70.23 108.831 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.586 ' HB ' HG13 ' A' ' 11' ' ' VAL . 27.0 t -111.37 130.31 65.11 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 C-N-CA 123.809 0.844 . . . . 65.31 108.893 -178.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -120.2 141.15 50.17 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.252 0.621 . . . . 74.03 110.758 -173.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -74.59 116.33 15.16 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.487 0.715 . . . . 73.31 110.492 176.655 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 36.1 mm-40 -117.21 107.28 14.25 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.223 1.009 . . . . 64.03 108.623 171.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 63.18 -115.24 7.75 Favored Glycine 0 C--N 1.348 1.227 0 N-CA-C 111.124 -0.79 . . . . 52.3 111.124 -172.329 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -91.68 -32.21 15.53 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.504 0.721 . . . . 71.32 109.934 171.758 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 82.0 p -82.64 173.02 12.31 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.534 0.733 . . . . 61.41 112.129 -168.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -128.66 110.92 12.64 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.141 0.976 . . . . 75.12 110.365 -174.23 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.3 t -93.39 160.65 14.72 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.332 0.653 . . . . 44.31 110.672 177.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.502 HG21 ' HG3' ' A' ' 18' ' ' LYS . 48.1 t -100.42 120.86 50.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 123.203 0.601 . . . . 54.23 109.447 174.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -83.47 -53.07 5.97 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 123.938 0.895 . . . . 75.01 110.618 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 21.5 tpp180 -165.27 144.16 6.47 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.161 0.584 . . . . 63.53 110.422 177.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.545 HG23 HG22 ' A' ' 57' ' ' VAL . 59.2 mt -103.73 105.94 19.31 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 N-CA-C 107.934 -1.136 . . . . 74.44 107.934 172.032 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 57.4 m -97.98 103.89 15.87 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.621 0.769 . . . . 72.53 109.216 -178.033 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 36.3 ttp180 -85.93 147.4 26.26 Favored 'General case' 0 C--O 1.243 0.724 0 N-CA-C 109.501 -0.555 . . . . 75.32 109.501 175.253 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 10.0 t . . . . . 0 CA--C 1.554 1.118 0 O-C-N 123.771 0.669 . . . . 72.44 110.151 171.272 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 . . . . . 0 N--CA 1.478 0.939 0 N-CA-C 111.672 0.249 . . . . 74.43 111.672 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.481 ' O ' HG23 ' A' ' 11' ' ' VAL . 44.7 mt-10 -52.4 -52.57 53.09 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 124.322 1.014 . . . . 72.41 110.448 175.609 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.451 ' O ' ' HG3' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -62.38 -42.42 99.4 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 124.545 1.153 . . . . 70.11 109.529 -175.731 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -59.58 -42.66 93.01 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.145 0.978 . . . . 75.42 110.567 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.417 ' O ' HG23 ' A' ' 14' ' ' VAL . 61.7 mt-30 -66.44 -49.79 65.53 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.218 1.007 . . . . 63.32 110.874 177.431 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.51 HG21 HD12 ' A' ' 40' ' ' ILE . 86.4 t -67.52 -35.27 72.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 124.012 0.925 . . . . 75.12 112.111 -170.64 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' A' ' 8' ' ' LYS . 53.4 mtmt -60.75 -36.36 78.72 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 122.704 0.402 . . . . 72.41 110.513 176.36 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.449 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 9.8 tt0 -71.39 -49.55 40.95 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 115.421 -0.809 . . . . 71.23 110.07 176.087 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.524 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 67.7 t -55.43 -40.25 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 123.396 0.678 . . . . 61.14 110.487 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.73 -47.64 58.67 Favored 'General case' 0 C--O 1.245 0.865 0 C-N-CA 124.603 1.161 . . . . 74.34 111.745 -176.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.401 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 22.4 ptmt -66.83 -33.92 76.67 Favored 'General case' 0 C--N 1.358 0.952 0 CA-C-N 116.134 -0.485 . . . . 72.4 110.714 -176.057 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.449 ' HG3' ' O ' ' A' ' 13' ' ' GLN . 53.0 mt-10 -61.18 -41.33 96.61 Favored 'General case' 0 C--N 1.36 1.047 0 O-C-N 124.064 0.852 . . . . 71.22 110.599 179.201 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.658 ' HG3' HG21 ' A' ' 68' ' ' VAL . 71.8 mmtt -68.25 -35.2 77.54 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 123.802 0.689 . . . . 61.44 110.825 -178.337 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 77.6 mt -70.08 -30.04 67.18 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.107 0.563 . . . . 73.34 111.535 173.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 95.1 mt -81.38 -16.77 51.24 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.667 0.787 . . . . 63.51 110.737 175.345 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -81.2 -46.1 15.36 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 109.427 -0.582 . . . . 73.3 109.427 172.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -71.85 -24.34 61.67 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.291 0.636 . . . . 73.54 111.319 178.231 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 t -158.01 82.83 2.83 Favored Pre-proline 0 CA--C 1.558 1.273 0 O-C-N 123.421 0.45 . . . . 64.24 110.138 -178.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -61.37 -33.57 88.63 Favored 'Trans proline' 0 C--N 1.381 2.282 0 C-N-CA 123.411 2.741 . . . . 73.52 115.01 -177.494 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -76.14 -18.45 59.12 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 122.815 0.446 . . . . 65.24 112.103 -175.336 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 58.3 m -76.64 148.68 36.75 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.381 0.672 . . . . 74.11 111.797 -177.116 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.512 ' HE3' ' HA ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -103.34 116.33 32.24 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.913 0.885 . . . . 72.34 109.77 174.107 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 51.1 t -99.36 141.24 17.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 CA-C-N 114.705 -1.134 . . . . 75.11 109.525 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -131.63 110.78 11.17 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 108.005 -1.109 . . . . 75.12 108.005 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.451 HG21 ' HB3' ' A' ' 12' ' ' LYS . 73.9 t -58.73 114.57 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 N-CA-C 109.434 -0.58 . . . . 73.14 109.434 178.106 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -92.29 -46.64 7.61 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 123.882 0.739 . . . . 74.1 110.756 -171.251 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 21.0 tpt180 -157.24 155.33 30.63 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.455 0.702 . . . . 72.23 109.951 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 89.9 t -126.42 141.46 45.83 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 124.33 1.052 . . . . 65.23 109.43 176.183 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 74.2 mm-40 -128.01 109.17 11.3 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 124.353 1.061 . . . . 65.04 108.931 177.447 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -92.12 110.72 22.1 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 108.084 -1.08 . . . . 71.12 108.084 178.079 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -122.9 90.28 3.26 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.314 0.646 . . . . 73.1 110.104 -179.64 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.56 -81.95 0.95 Allowed Glycine 0 C--N 1.35 1.352 0 CA-C-N 116.246 -0.433 . . . . 70.42 112.485 177.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -142.86 1.07 1.27 Allowed 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.695 1.198 . . . . 73.13 110.61 169.214 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 23.5 m -98.13 97.76 9.15 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.755 -0.831 . . . . 64.21 108.755 174.306 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.51 HD12 HG21 ' A' ' 11' ' ' VAL . 32.5 mt -92.49 107.66 19.27 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 C-N-CA 123.371 0.669 . . . . 52.31 110.067 178.735 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.519 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 94.3 mtt180 -87.41 105.26 17.15 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.389 1.076 . . . . 71.14 109.304 174.592 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 50.1 t -96.98 119.51 45.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 N-CA-C 109.086 -0.709 . . . . 72.41 109.086 175.762 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -83.16 116.58 22.42 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 108.62 -0.882 . . . . 54.13 108.62 170.126 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.4 mp -116.23 153.64 31.51 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 109.088 -0.708 . . . . 72.04 109.088 176.154 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -115.76 104.23 11.46 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 124.191 0.996 . . . . 74.02 108.474 -171.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.0 tt -98.95 111.15 23.63 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 108.36 -0.978 . . . . 75.22 108.36 -173.203 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 57.4 mtt85 . . . . . 0 N--CA 1.474 0.757 0 C-N-CA 123.664 0.786 . . . . 74.31 110.152 -176.254 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.3 pttt . . . . . 0 N--CA 1.471 0.597 0 N-CA-C 109.669 -0.493 . . . . 75.44 109.669 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 49.8 mm-40 -127.38 119.62 26.61 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 107.89 -1.152 . . . . 62.55 107.89 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 60.7 t30 -83.13 119.19 24.2 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 108.651 -0.87 . . . . 62.25 108.651 175.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -107.88 117.69 34.77 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 124.017 0.927 . . . . 72.01 109.303 177.018 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 59.0 m -84.43 100.43 11.32 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 107.909 -1.145 . . . . 72.25 107.909 168.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.452 HG22 HG23 ' A' ' 71' ' ' ILE . 57.6 t -91.99 103.83 14.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.447 0 N-CA-C 108.082 -1.081 . . . . 73.43 108.082 -179.557 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.519 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 30.1 mt-10 -79.01 102.13 8.18 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 114.57 -1.195 . . . . 73.43 108.723 -178.727 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.661 HG22 HG22 ' A' ' 68' ' ' VAL . 58.7 t -104.39 143.41 16.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 124.275 1.03 . . . . 74.42 108.894 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -136.14 147.83 47.92 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.462 0.705 . . . . 74.3 110.208 -179.047 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.5 tpp180 -76.57 117.58 18.36 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.785 0.834 . . . . 73.35 110.171 177.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -119.0 126.56 52.02 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 107.592 -1.262 . . . . 71.41 107.592 168.53 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 65.54 -104.5 1.0 Allowed Glycine 0 C--N 1.346 1.118 0 N-CA-C 111.122 -0.791 . . . . 72.12 111.122 -172.544 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -127.16 -5.06 6.14 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.89 0.876 . . . . 73.43 110.075 174.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 77.6 p -102.38 174.7 5.79 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.503 0.721 . . . . 73.31 111.171 -176.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -112.39 133.75 54.3 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.557 1.143 . . . . 74.3 110.637 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.1 t -128.23 151.99 48.62 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.26 1.024 . . . . 74.42 108.932 177.775 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.661 HG22 HG22 ' A' ' 59' ' ' VAL . 77.9 t -92.52 119.25 39.78 Favored 'Isoleucine or valine' 0 C--O 1.241 0.61 0 N-CA-C 109.941 -0.392 . . . . 74.23 109.941 175.312 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -70.07 -56.79 6.0 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 114.813 -1.085 . . . . 73.3 110.607 173.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -160.62 139.23 10.16 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 123.625 0.578 . . . . 64.4 110.02 178.01 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.452 HG23 HG22 ' A' ' 57' ' ' VAL . 59.3 mt -89.9 105.43 16.13 Favored 'Isoleucine or valine' 0 C--O 1.239 0.517 0 N-CA-C 107.975 -1.12 . . . . 73.44 107.975 168.292 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 96.1 m -97.14 105.85 18.08 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.485 0.714 . . . . 53.13 109.762 175.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 12.8 ttp180 -71.22 149.28 46.43 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 109.192 -0.67 . . . . 75.3 109.192 172.604 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 12.0 t . . . . . 0 CA--C 1.543 0.696 0 N-CA-C 109.423 -0.584 . . . . 74.52 109.423 175.028 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 . . . . . 0 N--CA 1.481 1.087 0 CA-C-O 121.281 0.562 . . . . 65.23 110.626 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.543 ' O ' HG23 ' A' ' 11' ' ' VAL . 20.2 mm-40 -64.36 -39.73 94.45 Favored 'General case' 0 C--O 1.207 -1.162 0 CA-C-O 118.008 -0.996 . . . . 75.03 111.06 178.317 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.3 mptt -59.55 -36.4 76.11 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-N 119.319 0.963 . . . . 75.04 110.956 176.756 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -59.51 -31.33 69.27 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.281 0.632 . . . . 62.31 110.694 176.434 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.44 ' O ' HG23 ' A' ' 14' ' ' VAL . 39.2 mt-30 -82.45 -47.61 12.04 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 115.444 -0.798 . . . . 64.44 111.887 174.326 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.579 HG21 HD12 ' A' ' 40' ' ' ILE . 73.1 t -73.1 -45.5 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.186 0 C-N-CA 123.783 0.833 . . . . 54.24 112.08 -165.312 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.637 ' HD2' HG11 ' A' ' 30' ' ' VAL . 25.8 mtmm -69.43 -26.16 64.47 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 109.565 -0.532 . . . . 62.13 109.565 179.619 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.426 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 23.0 tt0 -71.34 -44.84 64.31 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.2 1.0 . . . . 63.41 110.318 176.741 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.465 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 82.6 t -61.51 -48.14 90.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 N-CA-C 108.85 -0.796 . . . . 63.01 108.85 174.341 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.9 -39.84 93.36 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.49 1.116 . . . . 75.24 112.228 -174.599 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -69.94 -38.05 76.07 Favored 'General case' 0 C--N 1.355 0.826 0 O-C-N 123.263 0.352 . . . . 74.24 110.278 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 28.2 mm-40 -68.23 -34.8 76.89 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 122.743 0.417 . . . . 74.5 110.618 177.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.638 ' HB3' HD11 ' A' ' 71' ' ' ILE . 31.7 mmmt -63.84 -33.0 74.71 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 122.952 0.501 . . . . 70.33 110.813 176.139 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.782 ' HB3' HD12 ' A' ' 46' ' ' LEU . 32.6 mt -76.15 -36.97 58.53 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.733 -0.667 . . . . 73.31 111.532 174.735 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.0 mt -73.58 -16.38 61.25 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.251 0.62 . . . . 64.13 111.614 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -61.77 -39.5 91.86 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.433 0.635 . . . . 55.3 110.508 167.538 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -84.8 -34.25 22.79 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 114.445 -1.252 . . . . 64.14 110.976 -175.524 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.425 ' HB3' HD11 ' A' ' 46' ' ' LEU . 15.2 t -153.03 88.81 3.77 Favored Pre-proline 0 CA--C 1.555 1.159 0 N-CA-C 109.169 -0.678 . . . . 71.31 109.169 -177.411 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -62.54 -44.57 17.33 Favored 'Trans proline' 0 C--N 1.384 2.418 0 C-N-CA 123.425 2.75 . . . . 72.3 114.36 -176.33 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -83.15 -2.99 56.88 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.359 0.663 . . . . 74.23 112.006 -171.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.6 t -83.74 158.39 21.79 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 122.922 0.489 . . . . 71.31 111.218 177.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.34 134.13 35.2 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 123.481 0.712 . . . . 70.12 109.86 177.677 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.432 ' HA ' ' O ' ' A' ' 45' ' ' GLU . 80.9 t -117.21 113.98 44.35 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 C-N-CA 123.522 0.729 . . . . 65.23 109.912 177.215 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -109.48 122.12 46.7 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.459 1.104 . . . . 60.42 109.062 172.322 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.637 HG11 ' HD2' ' A' ' 12' ' ' LYS . 57.5 t -65.79 116.33 4.92 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 N-CA-C 109.238 -0.653 . . . . 75.32 109.238 176.042 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.0 tpt180 -83.14 -51.89 7.11 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.389 0.676 . . . . 60.3 110.267 -174.619 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.401 ' HB2' ' HB2' ' A' ' 43' ' ' GLU . 37.1 mtp85 -146.0 156.4 43.47 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.6 1.16 . . . . 72.24 109.67 -177.522 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 75.1 t -132.64 117.62 31.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 C-N-CA 123.891 0.876 . . . . 65.3 108.839 175.259 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -112.91 128.44 56.47 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.21 0.604 . . . . 74.31 110.033 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.5 tptp -108.66 109.76 21.03 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.296 1.039 . . . . 73.2 108.792 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.0 mm-40 -132.1 103.17 6.12 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.426 0.69 . . . . 70.34 109.953 -178.013 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.34 -101.99 0.89 Allowed Glycine 0 C--N 1.356 1.676 0 CA-C-N 115.92 -0.582 . . . . 74.12 112.519 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -113.22 -23.22 10.07 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.524 0.73 . . . . 75.12 109.715 173.33 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 16.6 m -85.14 105.71 16.06 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.491 0.716 . . . . 65.21 110.437 -176.293 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.579 HD12 HG21 ' A' ' 11' ' ' VAL . 31.2 mt -85.46 108.1 16.86 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 N-CA-C 109.29 -0.633 . . . . 73.15 109.29 168.872 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 -87.71 95.93 10.25 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 108.458 -0.942 . . . . 64.42 108.458 175.434 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.5 t -88.15 118.38 33.66 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 N-CA-C 108.824 -0.806 . . . . 61.04 108.824 179.096 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.401 ' HB2' ' HB2' ' A' ' 32' ' ' ARG . 46.3 mt-10 -90.3 120.85 31.79 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 108.605 -0.887 . . . . 73.21 108.605 173.221 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.5 mp -122.44 170.05 10.36 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 109.728 -0.471 . . . . 65.43 109.728 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.586 ' HG3' ' HG3' ' A' ' 52' ' ' LYS . 29.4 tt0 -120.7 105.16 10.51 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.48 1.112 . . . . 64.34 108.695 -176.365 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.782 HD12 ' HB3' ' A' ' 19' ' ' LEU . 6.9 tt -107.27 133.83 51.25 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 106.402 -1.703 . . . . 73.53 106.402 172.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 87.1 mtt180 . . . . . 0 CA--C 1.539 0.534 0 CA-C-O 121.834 0.826 . . . . 74.51 109.66 -174.096 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.586 ' HG3' ' HG3' ' A' ' 45' ' ' GLU . 84.4 tttt . . . . . 0 CA--C 1.541 0.623 0 N-CA-C 109.766 -0.457 . . . . 73.43 109.766 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -111.89 118.87 36.71 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 107.851 -1.166 . . . . 71.4 107.851 172.133 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -88.06 132.9 34.11 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 109.878 -0.415 . . . . 44.2 109.878 177.715 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.439 ' CE2' ' HB3' ' A' ' 46' ' ' LEU . 66.6 m-85 -124.07 119.8 30.55 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 109.167 -0.679 . . . . 62.2 109.167 178.943 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 26.7 m -87.11 101.9 13.93 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 108.507 -0.923 . . . . 50.32 108.507 173.229 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.498 HG22 HG23 ' A' ' 71' ' ' ILE . 46.3 t -92.04 104.6 15.75 Favored 'Isoleucine or valine' 0 C--O 1.24 0.595 0 N-CA-C 108.007 -1.109 . . . . 55.4 108.007 177.51 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -80.93 105.24 12.01 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 114.511 -1.222 . . . . 75.55 109.344 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 20.8 t -112.91 134.57 55.11 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 108.806 -0.812 . . . . 73.43 108.806 178.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -121.95 142.71 50.02 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.302 0.641 . . . . 63.05 111.183 -174.268 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.85 114.92 19.14 Favored 'General case' 0 C--N 1.35 0.596 0 C-N-CA 123.787 0.835 . . . . 72.25 109.53 174.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -120.84 102.92 8.69 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 107.647 -1.242 . . . . 65.41 107.647 172.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 72.66 -99.53 0.92 Allowed Glycine 0 C--N 1.347 1.177 0 N-CA-C 110.211 -1.156 . . . . 74.43 110.211 -172.376 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -122.48 -19.19 6.45 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.303 1.041 . . . . 72.02 110.261 169.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 68.1 p -76.79 136.97 38.99 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 122.911 0.485 . . . . 75.22 111.364 -175.294 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -96.23 111.81 23.75 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.07 0.948 . . . . 75.23 109.891 177.18 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.2 t -105.01 139.73 39.25 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.734 0.814 . . . . 75.14 109.844 -177.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.488 HG21 ' HG3' ' A' ' 18' ' ' LYS . 59.0 t -91.14 116.65 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 O-C-N 121.709 -0.619 . . . . 71.43 110.379 177.198 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -71.37 -57.38 4.51 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.532 1.133 . . . . 54.13 111.091 175.593 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -162.09 133.53 5.29 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.584 -0.734 . . . . 50.5 109.844 -173.031 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.638 HD11 ' HB3' ' A' ' 18' ' ' LYS . 56.5 mt -91.48 105.21 16.3 Favored 'Isoleucine or valine' 0 C--O 1.241 0.614 0 N-CA-C 106.636 -1.616 . . . . 73.33 106.636 163.711 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 27.2 m -101.25 108.46 20.12 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.108 -0.701 . . . . 61.23 109.108 -176.524 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -67.54 138.67 56.68 Favored 'General case' 0 C--O 1.241 0.625 0 N-CA-C 108.81 -0.811 . . . . 74.02 108.81 171.13 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.1 t . . . . . 0 C--O 1.247 0.934 0 C-N-CA 123.58 0.752 . . . . 73.25 110.605 175.285 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.424 ' HA ' ' HD2' ' A' ' 9' ' ' ARG . 11.7 tp10 . . . . . 0 C--O 1.245 0.816 0 N-CA-C 111.312 0.116 . . . . 74.23 111.312 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.546 ' O ' HG23 ' A' ' 11' ' ' VAL . 72.9 mt-10 -50.5 -66.74 0.34 Allowed 'General case' 0 C--N 1.364 1.205 0 O-C-N 124.022 0.826 . . . . 70.35 109.981 173.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.478 ' HD2' ' HB2' ' A' ' 7' ' ' GLU . 10.6 mptt -66.0 -27.82 68.42 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 123.908 0.755 . . . . 70.22 111.295 -169.453 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.424 ' HD2' ' HA ' ' A' ' 6' ' ' GLU . 90.5 mtt180 -59.71 -40.14 86.94 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.091 0.556 . . . . 72.52 110.398 176.295 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -77.91 -51.38 10.51 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 115.107 -0.951 . . . . 64.43 110.751 173.589 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.546 HG23 ' O ' ' A' ' 7' ' ' GLU . 52.0 t -66.04 -44.77 91.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 123.653 0.781 . . . . 64.43 112.486 -164.617 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.403 ' HD2' HG11 ' A' ' 30' ' ' VAL . 29.1 mtmm -66.05 -31.97 73.16 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 123.165 0.29 . . . . 71.42 110.394 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.412 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 58.5 tt0 -70.76 -43.82 68.01 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 124.107 0.879 . . . . 74.3 110.185 178.416 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.479 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 87.8 t -65.08 -39.83 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 N-CA-C 109.557 -0.534 . . . . 64.14 109.557 176.023 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.91 -44.2 81.37 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.198 0.999 . . . . 71.51 111.598 -175.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -67.85 -34.82 77.45 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 123.793 0.683 . . . . 75.44 110.164 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.484 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 22.4 mm-40 -61.01 -46.02 92.46 Favored 'General case' 0 C--N 1.356 0.848 0 O-C-N 123.633 0.583 . . . . 65.54 111.077 177.537 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.607 ' HB3' HD11 ' A' ' 71' ' ' ILE . 71.5 mmtt -67.22 -30.66 70.65 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.669 0.606 . . . . 75.45 111.09 -178.466 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.565 ' HB3' HD12 ' A' ' 46' ' ' LEU . 41.7 mt -70.15 -36.26 74.62 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.396 0.678 . . . . 64.24 111.442 174.29 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.3 mt -76.06 -22.89 55.15 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 123.764 0.826 . . . . 55.21 110.57 176.185 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 7.4 mm-40 -69.15 -36.94 77.97 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.261 0.624 . . . . 75.14 110.147 171.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -76.16 -42.06 47.86 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.21 0.604 . . . . 73.12 110.944 176.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.4 t -148.85 96.71 3.75 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 123.062 0.545 . . . . 73.12 110.368 -174.662 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -82.55 -1.98 10.83 Favored 'Trans proline' 0 C--N 1.372 1.805 0 C-N-CA 123.228 2.619 . . . . 71.4 112.434 172.783 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -83.41 -3.88 57.97 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.671 1.188 . . . . 61.11 111.676 178.492 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 34.4 p -127.09 142.56 51.49 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.382 0.673 . . . . 74.42 111.979 -168.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -77.85 136.43 38.07 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 123.818 0.699 . . . . 73.25 109.587 169.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 60.3 t -112.61 134.99 53.43 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 C-N-CA 123.973 0.909 . . . . 74.03 108.938 177.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -128.95 149.6 50.73 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.826 0.851 . . . . 70.11 109.396 176.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.403 HG11 ' HD2' ' A' ' 12' ' ' LYS . 73.8 t -77.05 110.35 12.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 N-CA-C 109.96 -0.385 . . . . 73.54 109.96 176.189 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -81.44 -59.57 2.58 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.656 0.782 . . . . 63.12 110.09 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.424 ' HB2' ' HB2' ' A' ' 43' ' ' GLU . 17.6 mmm180 -148.82 167.26 26.12 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.885 1.274 . . . . 70.2 108.981 -176.276 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.403 HG22 HG13 ' A' ' 42' ' ' VAL . 59.2 t -135.45 139.76 46.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 N-CA-C 108.704 -0.85 . . . . 62.13 108.704 171.179 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -125.6 108.25 11.39 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 109.112 -0.699 . . . . 75.04 109.112 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -96.43 113.51 25.1 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 107.972 -1.122 . . . . 74.04 107.972 176.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 92.4 mm-40 -131.96 99.05 4.61 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.879 -0.786 . . . . 74.51 108.879 176.07 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 63.06 -102.53 0.53 Allowed Glycine 0 C--N 1.348 1.238 0 O-C-N 124.386 1.054 . . . . 72.3 112.908 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -97.15 -39.76 9.13 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.571 0.748 . . . . 63.22 109.838 174.353 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.438 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 11.5 m -80.69 96.42 6.9 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 123.296 0.638 . . . . 60.31 110.803 -172.061 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 28.8 mt -87.54 107.32 17.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 115.779 -0.646 . . . . 64.02 109.357 168.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 31.6 mtm180 -87.82 96.07 10.33 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 108.01 -1.107 . . . . 72.22 108.01 174.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.403 HG13 HG22 ' A' ' 33' ' ' VAL . 48.6 t -82.59 121.17 35.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 N-CA-C 109.034 -0.728 . . . . 74.41 109.034 177.073 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.424 ' HB2' ' HB2' ' A' ' 32' ' ' ARG . 37.6 mt-10 -89.45 118.11 28.86 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.416 -0.811 . . . . 74.15 109.095 176.116 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.8 mp -122.99 164.04 19.29 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 108.823 -0.806 . . . . 74.12 108.823 176.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -125.56 111.82 15.48 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.633 0.773 . . . . 70.52 108.916 -169.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.565 HD12 ' HB3' ' A' ' 19' ' ' LEU . 8.5 tt -120.41 137.68 54.18 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.173 1.389 . . . . 62.14 108.361 -171.733 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 14.5 mtm180 . . . . . 0 N--CA 1.48 1.07 0 N-CA-C 109.476 -0.565 . . . . 74.22 109.476 -178.507 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt . . . . . 0 C--O 1.241 0.629 0 N-CA-C 108.983 -0.747 . . . . 71.21 108.983 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -108.59 134.61 51.11 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.907 0.883 . . . . 72.13 110.399 -175.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -88.43 120.87 30.21 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.633 -0.712 . . . . 74.54 110.525 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.517 ' CE2' ' HB3' ' A' ' 46' ' ' LEU . 19.1 m-85 -104.71 157.8 16.94 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.02 0.928 . . . . 65.31 109.801 177.496 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 85.3 m -134.23 103.04 5.59 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 107.984 -1.117 . . . . 70.33 107.984 173.575 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.43 HG22 HG23 ' A' ' 71' ' ' ILE . 52.0 t -90.1 105.25 16.01 Favored 'Isoleucine or valine' 0 C--O 1.241 0.647 0 N-CA-C 107.56 -1.274 . . . . 74.32 107.56 -179.446 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -77.12 111.27 12.54 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 114.891 -1.049 . . . . 62.31 109.129 -179.804 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 24.7 t -122.81 122.59 66.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 123.635 0.774 . . . . 51.01 109.39 -178.146 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.438 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 29.8 tt0 -105.85 145.57 31.05 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.114 0.965 . . . . 72.3 110.859 -176.213 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 14.5 tpp180 -75.42 121.25 22.02 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 109.782 -0.451 . . . . 75.1 109.782 171.504 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -117.39 101.8 8.7 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.503 -0.925 . . . . 72.14 108.503 167.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.75 -106.24 1.76 Allowed Glycine 0 C--N 1.348 1.239 0 CA-C-N 115.96 -0.564 . . . . 64.32 111.98 -178.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -108.98 -19.71 13.3 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.342 0.657 . . . . 64.32 110.296 177.665 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.2 p -93.76 173.88 7.46 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.465 0.65 . . . . 70.24 111.442 -178.15 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -116.08 150.55 37.15 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.479 1.111 . . . . 73.15 109.442 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.3 t -134.77 123.15 23.14 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 109.457 -0.571 . . . . 72.34 109.457 -179.441 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.557 HG21 ' HG3' ' A' ' 18' ' ' LYS . 95.5 t -74.93 103.67 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 N-CA-C 108.812 -0.81 . . . . 72.24 108.812 175.845 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.5 mmmp? -64.4 -52.77 56.54 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 123.934 0.894 . . . . 74.03 110.196 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -163.62 152.61 14.17 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.464 -0.789 . . . . 64.3 109.895 178.472 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.607 HD11 ' HB3' ' A' ' 18' ' ' LYS . 70.5 mt -101.95 110.14 27.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 N-CA-C 108.029 -1.1 . . . . 72.04 108.029 170.086 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 17.4 m -91.65 142.8 27.23 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 108.542 -0.91 . . . . 54.01 108.542 178.079 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 27.9 ttp180 -118.31 144.33 45.93 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 107.536 -1.283 . . . . 63.21 107.536 168.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.4 t . . . . . 0 C--O 1.248 0.996 0 C-N-CA 122.943 0.497 . . . . 75.53 109.994 176.294 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.412 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 45.2 mt-10 . . . . . 0 N--CA 1.481 1.085 0 N-CA-C 110.348 -0.241 . . . . 74.35 110.348 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.509 ' O ' HG23 ' A' ' 11' ' ' VAL . 51.1 mm-40 -63.47 -40.93 98.42 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 123.899 0.749 . . . . 75.13 111.35 178.663 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.19 -41.65 98.55 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.247 0.619 . . . . 61.55 110.32 179.43 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -58.83 -44.79 90.97 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 124.026 0.93 . . . . 72.12 110.822 175.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.452 ' O ' HG23 ' A' ' 14' ' ' VAL . 68.5 mt-30 -62.96 -45.11 93.97 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 114.904 -1.044 . . . . 74.44 111.089 179.249 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.52 HG21 HD12 ' A' ' 40' ' ' ILE . 87.6 t -66.71 -43.51 90.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 123.621 0.769 . . . . 73.34 111.423 -176.309 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -61.45 -37.69 84.49 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 123.486 0.491 . . . . 75.54 110.442 176.659 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.512 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.5 tt0 -65.79 -49.14 69.38 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 124.119 0.887 . . . . 74.43 110.323 179.03 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 10' ' ' GLN . 89.0 t -58.12 -45.69 88.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 C-N-CA 123.068 0.547 . . . . 62.34 109.784 176.341 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.84 -42.29 97.63 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.175 0.99 . . . . 51.41 112.179 -175.635 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -73.72 -35.44 65.09 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 116.317 -0.401 . . . . 72.34 110.667 -176.314 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 25.3 mm-40 -65.87 -37.13 85.33 Favored 'General case' 0 C--N 1.353 0.732 0 O-C-N 123.422 0.451 . . . . 75.33 110.369 176.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.634 ' HB3' HD11 ' A' ' 71' ' ' ILE . 65.9 mmtt -63.26 -37.1 85.94 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.347 0.659 . . . . 74.53 110.897 176.218 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 23.8 mt -72.49 -30.65 64.71 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 115.85 -0.614 . . . . 64.42 111.414 176.086 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 75.5 mt -76.19 -19.68 58.2 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.333 0.653 . . . . 64.31 111.045 177.127 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -77.0 -21.12 55.17 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.018 0.527 . . . . 71.22 110.714 170.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 -88.64 -38.12 15.06 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.165 0.586 . . . . 73.25 110.226 175.293 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.8 t -157.31 102.51 1.87 Allowed Pre-proline 0 CA--C 1.552 1.048 0 C-N-CA 124.208 1.003 . . . . 42.32 109.215 -176.901 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -77.04 -27.61 6.69 Favored 'Trans proline' 0 C--N 1.373 1.824 0 C-N-CA 122.796 2.331 . . . . 74.24 112.851 -176.891 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -74.46 -27.93 60.8 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.766 0.826 . . . . 62.54 111.18 -173.673 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 54.5 m -80.47 130.04 34.9 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 123.299 0.64 . . . . 74.13 111.373 -174.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -73.67 123.49 24.15 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 123.509 0.724 . . . . 75.14 109.697 175.814 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.54 HG22 HD12 ' A' ' 46' ' ' LEU . 40.8 t -99.68 113.29 34.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 123.315 0.646 . . . . 74.34 109.617 -177.074 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -94.61 151.72 19.09 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.945 -0.761 . . . . 52.11 108.945 174.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 p -87.09 105.75 15.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 N-CA-C 108.936 -0.765 . . . . 62.44 108.936 171.552 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -77.21 -42.7 36.41 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.249 0.62 . . . . 72.41 110.435 -177.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 17.5 tpp85 -170.01 155.55 5.63 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.976 0.91 . . . . 61.31 109.452 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 25.2 t -117.21 117.19 54.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.354 -0.98 . . . . 70.15 108.354 171.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -104.55 145.59 30.09 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 109.423 -0.584 . . . . 61.22 109.423 174.741 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.565 ' HG2' HG12 ' A' ' 40' ' ' ILE . 13.2 tmtt? -136.53 117.25 13.99 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 107.166 -1.42 . . . . 74.13 107.166 -177.824 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -133.25 96.3 3.71 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.082 0.953 . . . . 63.51 108.733 -175.733 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.47 -92.76 0.28 Allowed Glycine 0 C--N 1.348 1.248 0 O-C-N 123.555 0.535 . . . . 72.53 112.215 -177.901 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.43 ' HB3' ' HB3' ' A' ' 61' ' ' ARG . 47.6 m-80 -114.18 -25.23 8.57 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.971 0.909 . . . . 75.23 110.741 175.079 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.567 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 19.9 m -81.79 103.8 11.73 Favored 'General case' 0 C--O 1.24 0.587 0 C-N-CA 123.158 0.583 . . . . 75.11 111.252 -176.528 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.565 HG12 ' HG2' ' A' ' 35' ' ' LYS . 39.6 mt -86.76 107.12 16.54 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 N-CA-C 109.063 -0.717 . . . . 63.31 109.063 168.4 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.425 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 95.0 mtt180 -92.29 96.72 10.45 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 108.406 -0.961 . . . . 73.34 108.406 176.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.412 HG12 ' HG ' ' A' ' 44' ' ' LEU . 39.2 t -80.25 120.7 32.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 N-CA-C 108.421 -0.955 . . . . 54.34 108.421 176.614 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -84.89 115.49 22.8 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 107.482 -1.303 . . . . 74.53 107.482 170.159 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.412 ' HG ' HG12 ' A' ' 42' ' ' VAL . 1.9 mp -117.82 142.87 46.82 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 109.594 -0.521 . . . . 73.5 109.594 178.669 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -107.2 104.82 14.55 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.916 0.886 . . . . 72.02 108.787 -175.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.54 HD12 HG22 ' A' ' 28' ' ' VAL . 8.3 tt -117.2 135.46 53.77 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.323 1.049 . . . . 60.3 108.747 -175.85 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 64.6 mtm180 . . . . . 0 CA--C 1.542 0.671 0 N-CA-C 109.306 -0.627 . . . . 73.33 109.306 -178.395 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.9 tttt . . . . . 0 N--CA 1.472 0.646 0 CA-C-O 120.86 0.362 . . . . 73.21 110.208 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -127.64 118.78 24.51 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.775 0.83 . . . . 72.2 109.815 -177.458 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -80.32 147.07 31.27 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.812 -0.81 . . . . 62.1 108.812 171.431 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 -129.88 120.57 25.13 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.762 0.825 . . . . 55.24 108.829 179.075 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 90.8 m -85.44 100.64 12.01 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 108.404 -0.962 . . . . 71.21 108.404 170.695 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.483 HG22 HG23 ' A' ' 71' ' ' ILE . 43.4 t -97.52 102.87 13.99 Favored 'Isoleucine or valine' 0 C--O 1.243 0.728 0 N-CA-C 107.591 -1.263 . . . . 72.25 107.591 175.075 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.425 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 31.7 mt-10 -80.57 101.52 9.21 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 114.319 -1.31 . . . . 73.24 108.483 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.502 ' HB ' HG13 ' A' ' 11' ' ' VAL . 21.2 t -109.39 109.45 28.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 N-CA-C 107.84 -1.17 . . . . 71.01 107.84 177.754 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.567 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 45.8 tt0 -101.9 146.34 27.97 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.729 0.811 . . . . 75.41 109.767 -175.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.43 ' HB3' ' HB3' ' A' ' 38' ' ' ASN . 8.6 tpt180 -80.49 111.24 16.72 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.659 0.784 . . . . 73.11 110.595 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 -106.11 93.5 4.65 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 108.398 -0.964 . . . . 55.23 108.398 174.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.08 -100.69 0.73 Allowed Glycine 0 C--N 1.344 1.011 0 CA-C-N 115.549 -0.75 . . . . 44.45 112.045 -177.606 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -105.65 -26.08 11.99 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.23 1.012 . . . . 73.41 110.831 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.2 p -93.61 160.65 14.68 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.579 0.752 . . . . 73.13 111.686 -174.098 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -108.16 109.81 21.3 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.625 1.17 . . . . 74.41 109.821 176.62 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 9.8 t -103.83 127.67 51.31 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.67 0.788 . . . . 71.14 110.712 -178.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.467 HG22 HG22 ' A' ' 59' ' ' VAL . 63.6 t -77.51 110.14 12.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 N-CA-C 109.617 -0.512 . . . . 64.01 109.617 176.551 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -69.05 -49.52 56.81 Favored 'General case' 0 C--O 1.24 0.58 0 C-N-CA 123.363 0.665 . . . . 74.11 110.534 178.153 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -166.69 143.1 4.66 Favored 'General case' 0 C--N 1.348 0.501 0 CA-C-N 116.291 -0.413 . . . . 73.2 111.49 177.489 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.634 HD11 ' HB3' ' A' ' 18' ' ' LYS . 56.8 mt -97.84 106.95 19.37 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 N-CA-C 107.739 -1.208 . . . . 73.13 107.739 166.442 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 37.4 m -102.51 119.73 39.31 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.307 0.643 . . . . 75.41 109.48 178.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 28.4 ttp180 -75.93 148.08 38.47 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 109.331 -0.618 . . . . 74.43 109.331 176.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.4 t . . . . . 0 N--CA 1.478 0.925 0 C-N-CA 124.394 1.078 . . . . 71.14 112.616 -173.106 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 . . . . . 0 N--CA 1.472 0.647 0 N-CA-C 111.769 0.285 . . . . 65.14 111.769 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.506 ' O ' HG23 ' A' ' 11' ' ' VAL . 9.8 mm-40 -57.42 -43.32 83.7 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.987 0.915 . . . . 72.43 111.914 -175.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.454 ' HD2' ' N ' ' A' ' 8' ' ' LYS . 10.5 mptt -68.76 -48.21 64.3 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 108.872 -0.788 . . . . 74.12 108.872 -179.276 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -59.13 -34.53 72.16 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.697 1.199 . . . . 61.25 112.117 -177.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 61.7 mt-30 -70.89 -53.62 14.45 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.633 0.773 . . . . 72.22 110.817 178.349 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.64 HG13 ' HB ' ' A' ' 59' ' ' VAL . 59.8 t -63.36 -44.59 99.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 123.27 0.628 . . . . 75.31 111.639 -172.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.607 ' HD2' HG11 ' A' ' 30' ' ' VAL . 48.2 mtmt -66.02 -33.8 76.63 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.396 0.679 . . . . 74.31 110.592 -179.376 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.509 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.4 tt0 -66.45 -59.11 3.97 Favored 'General case' 0 C--N 1.355 0.811 0 O-C-N 123.96 0.788 . . . . 63.34 109.699 176.215 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.4 t -52.49 -44.77 45.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 C-N-CA 124.435 1.094 . . . . 70.4 111.129 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.431 ' HB1' HD11 ' A' ' 44' ' ' LEU . . . -61.69 -42.05 98.41 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.282 1.033 . . . . 62.22 111.646 -179.392 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.407 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 32.3 tttm -65.54 -43.72 89.09 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.441 1.096 . . . . 61.3 110.719 175.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 15.7 mm-40 -61.24 -41.91 97.71 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 123.843 0.715 . . . . 74.15 110.573 -177.327 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.433 ' HB3' HD11 ' A' ' 71' ' ' ILE . 69.6 mmtt -64.56 -41.52 96.26 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 124.196 0.935 . . . . 75.11 110.966 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 77.3 mt -70.17 -27.61 64.66 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.0 0.52 . . . . 75.01 111.733 177.649 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 90.6 mt -73.63 -33.89 64.75 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.436 0.694 . . . . 40.12 110.36 174.359 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -71.1 -36.68 72.26 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.475 0.71 . . . . 74.13 110.783 177.468 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -76.43 -35.55 58.45 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.558 0.743 . . . . 74.42 111.457 178.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 29.8 t -148.24 93.74 4.35 Favored Pre-proline 0 CA--C 1.55 0.971 0 N-CA-C 109.433 -0.58 . . . . 70.23 109.433 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -76.0 -4.07 14.67 Favored 'Trans proline' 0 C--N 1.378 2.119 0 C-N-CA 122.792 2.328 . . . . 71.42 112.867 173.804 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -83.07 -19.46 36.8 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.055 0.942 . . . . 73.54 110.059 173.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.4 ' OG ' ' HG ' ' A' ' 46' ' ' LEU . 39.4 t -86.45 141.02 29.43 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 123.386 0.675 . . . . 75.52 112.325 -173.344 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -89.87 108.93 20.0 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 107.3 -1.37 . . . . 74.13 107.3 164.581 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 88.6 t -98.48 113.37 32.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 C-N-CA 123.82 0.848 . . . . 74.34 109.206 -176.111 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 61.3 tp60 -117.87 124.21 47.75 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.578 0.751 . . . . 75.43 109.811 -178.033 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.607 HG11 ' HD2' ' A' ' 12' ' ' LYS . 55.8 t -62.8 108.1 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 N-CA-C 109.309 -0.626 . . . . 75.43 109.309 174.348 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 24.1 tpt85 -88.43 -36.27 16.6 Favored 'General case' 0 CA--C 1.549 0.915 0 CA-C-N 115.28 -0.873 . . . . 72.24 111.607 -175.036 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -170.0 165.49 9.44 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.328 0.651 . . . . 71.11 109.336 -177.586 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.499 HG21 ' HD3' ' A' ' 12' ' ' LYS . 97.5 t -141.69 123.44 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 124.012 0.925 . . . . 72.51 109.594 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -101.31 109.99 21.92 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.209 0.604 . . . . 72.41 109.537 170.345 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.512 ' HG2' HG12 ' A' ' 40' ' ' ILE . 6.2 tmtm? -99.09 108.53 21.19 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 108.303 -0.999 . . . . 64.35 108.303 179.747 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 33.8 mm-40 -126.99 99.4 5.7 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.804 0.842 . . . . 73.41 110.413 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.04 -120.78 17.06 Favored Glycine 0 C--N 1.356 1.654 0 CA-C-N 115.322 -0.854 . . . . 73.23 112.641 176.014 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -77.05 -35.03 57.11 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.521 0.728 . . . . 74.11 110.654 178.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.458 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 89.5 m -87.95 126.39 35.03 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-O 121.319 0.58 . . . . 65.42 110.216 -175.502 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.512 HG12 ' HG2' ' A' ' 35' ' ' LYS . 33.3 mt -115.27 107.94 24.07 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 N-CA-C 107.836 -1.172 . . . . 54.3 107.836 173.829 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.582 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 94.4 mtt180 -83.31 131.62 35.07 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 123.905 0.882 . . . . 75.14 108.674 173.379 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.483 HG13 HG22 ' A' ' 33' ' ' VAL . 35.5 t -118.81 116.83 52.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 108.634 -0.876 . . . . 74.11 108.634 175.247 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -83.68 103.68 13.19 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 107.869 -1.159 . . . . 75.21 107.869 172.291 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.434 ' HG ' HG12 ' A' ' 42' ' ' VAL . 0.6 OUTLIER -109.6 166.85 10.58 Favored 'General case' 0 N--CA 1.484 1.235 0 N-CA-C 107.963 -1.125 . . . . 71.13 107.963 173.458 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -122.12 125.83 47.03 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.816 0.341 . . . . 72.35 110.255 -173.867 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.4 ' HG ' ' OG ' ' A' ' 26' ' ' SER . 10.0 tt -96.85 115.57 27.66 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.911 1.284 . . . . 70.51 107.692 -177.817 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 . . . . . 0 N--CA 1.482 1.173 0 C-N-CA 123.962 0.905 . . . . 74.02 110.222 -177.739 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 83.8 tttt . . . . . 0 N--CA 1.467 0.41 0 N-CA-C 107.579 -1.267 . . . . 74.44 107.579 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -138.32 130.97 29.32 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.862 0.865 . . . . 63.13 109.78 -178.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 35.6 m-80 -83.4 127.23 33.51 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.352 0.661 . . . . 53.31 110.61 178.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -106.5 119.98 40.72 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.985 0.914 . . . . 72.44 109.351 176.239 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 80.5 m -86.7 101.7 13.53 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 124.762 1.225 . . . . 62.32 108.817 172.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.546 HG22 HG23 ' A' ' 71' ' ' ILE . 45.5 t -93.31 105.45 16.84 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 N-CA-C 108.437 -0.949 . . . . 63.24 108.437 179.124 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.582 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 33.6 mt-10 -77.94 112.15 14.54 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.796 0.839 . . . . 61.25 108.774 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.64 ' HB ' HG13 ' A' ' 11' ' ' VAL . 17.6 t -124.66 115.31 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 N-CA-C 108.573 -0.899 . . . . 33.34 108.573 177.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.459 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 29.4 tt0 -100.7 148.3 25.03 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.069 0.948 . . . . 74.34 110.233 -176.516 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.12 114.13 19.76 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 109.262 -0.644 . . . . 73.12 109.262 176.161 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 -119.81 86.61 2.59 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 124.275 1.03 . . . . 65.15 108.276 177.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 68.55 -132.37 27.17 Favored Glycine 0 C--N 1.346 1.101 0 CA-C-N 115.692 -0.685 . . . . 61.14 111.631 -175.735 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -80.59 -2.17 45.25 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.714 0.806 . . . . 55.13 111.721 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 73.8 p -114.56 150.96 34.16 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.084 0.554 . . . . 74.45 110.563 -176.086 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 96.3 m95 -98.32 119.18 36.55 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.056 0.942 . . . . 75.42 108.827 168.675 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 10.0 t -103.13 121.29 42.32 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.442 0.697 . . . . 72.0 109.875 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 51.2 t -76.29 106.97 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 108.494 -0.928 . . . . 75.22 108.494 176.379 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.459 ' HD3' ' HB3' ' A' ' 60' ' ' GLU . 1.5 mmmp? -65.02 -57.13 9.49 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 115.589 -0.732 . . . . 61.35 110.128 -179.352 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 63.1 ttt180 -167.26 136.25 2.71 Favored 'General case' 0 C--N 1.352 0.676 0 CA-C-N 116.008 -0.542 . . . . 75.24 110.597 178.737 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.546 HG23 HG22 ' A' ' 57' ' ' VAL . 71.9 mt -87.35 105.91 15.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 107.653 -1.24 . . . . 73.41 107.653 171.763 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 19.6 m -107.07 115.5 30.29 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.341 0.656 . . . . 75.54 109.506 -174.287 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -68.84 149.9 48.42 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.015 0.526 . . . . 71.52 109.753 172.145 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.8 t . . . . . 0 N--CA 1.475 0.798 0 C-N-CA 123.791 0.837 . . . . 73.51 110.202 167.431 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 . . . . . 0 CA--C 1.546 0.792 0 CA-C-O 120.571 0.224 . . . . 54.24 110.802 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -64.22 -40.96 97.14 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 116.196 -0.456 . . . . 73.33 111.097 177.239 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.554 ' HG3' HG11 ' A' ' 33' ' ' VAL . 1.0 OUTLIER -62.49 -42.41 99.48 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 123.713 0.633 . . . . 63.3 110.016 177.755 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 41.8 ttt180 -56.77 -44.31 81.7 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.776 0.831 . . . . 74.33 111.131 177.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.524 ' O ' HG23 ' A' ' 14' ' ' VAL . 52.5 mt-30 -68.92 -45.97 69.49 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 114.929 -1.032 . . . . 72.12 110.945 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.61 HG21 HD12 ' A' ' 40' ' ' ILE . 55.1 t -70.84 -43.47 76.96 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 124.065 0.946 . . . . 74.34 112.243 -173.44 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -61.66 -36.05 79.72 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.171 0.588 . . . . 71.34 110.168 176.311 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.508 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 60.9 tt0 -64.22 -52.51 58.47 Favored 'General case' 0 C--N 1.354 0.764 0 O-C-N 124.088 0.867 . . . . 74.41 110.21 176.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.525 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 84.9 t -55.25 -44.43 75.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 123.137 0.575 . . . . 63.54 110.22 178.057 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.01 -47.91 75.79 Favored 'General case' 0 C--O 1.248 1.017 0 C-N-CA 124.664 1.186 . . . . 52.31 112.52 -176.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.415 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 14.8 ptmm? -68.1 -35.8 78.74 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 115.564 -0.744 . . . . 71.31 110.854 -175.878 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 38.9 mm-40 -62.5 -40.09 95.58 Favored 'General case' 0 C--N 1.353 0.727 0 O-C-N 123.772 0.67 . . . . 74.14 111.25 179.191 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.525 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 13.9 mmmm -64.45 -40.14 95.16 Favored 'General case' 0 CA--C 1.551 1.008 0 O-C-N 123.425 0.453 . . . . 74.1 110.85 178.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 81.9 mt -71.74 -29.47 64.56 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.98 0.912 . . . . 71.25 112.42 177.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 90.4 mt -73.63 -33.72 64.67 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.44 0.696 . . . . 73.51 110.256 175.592 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 50.0 mt-10 -66.63 -31.75 72.63 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.527 0.731 . . . . 64.02 110.776 173.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -77.56 -41.14 40.03 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.324 0.65 . . . . 65.1 111.587 176.229 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.0 t -144.7 88.78 6.92 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 122.788 0.435 . . . . 75.44 110.085 -176.611 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -75.46 -15.93 19.48 Favored 'Trans proline' 0 C--N 1.38 2.202 0 C-N-CA 123.393 2.729 . . . . 54.23 113.153 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -81.79 -13.86 57.16 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.39 0.676 . . . . 72.01 110.601 174.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 67.2 m -98.11 137.56 36.7 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.241 0.617 . . . . 51.24 110.521 176.222 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -84.72 117.17 23.65 Favored 'General case' 0 C--O 1.243 0.724 0 N-CA-C 107.808 -1.182 . . . . 74.44 107.808 166.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 66.5 t -99.21 112.43 31.39 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 O-C-N 123.501 0.501 . . . . 74.14 109.876 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -97.62 178.01 5.31 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.01 0.924 . . . . 74.32 108.897 174.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.2 p -105.99 125.52 61.52 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 N-CA-C 109.624 -0.51 . . . . 74.01 109.624 173.102 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.8 tpt180 -83.08 -59.03 2.61 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 109.281 -0.636 . . . . 55.33 109.281 178.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 21.5 mtm180 -146.14 166.31 26.54 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.466 1.106 . . . . 74.14 109.74 176.735 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.554 HG11 ' HG3' ' A' ' 8' ' ' LYS . 60.9 t -130.02 111.59 21.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 N-CA-C 107.401 -1.333 . . . . 43.5 107.401 176.006 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 24.8 tp60 -107.41 109.93 21.77 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 118.008 0.367 . . . . 72.01 110.185 -177.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -78.29 137.14 37.93 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 108.626 -0.879 . . . . 65.32 108.626 170.231 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -143.55 82.65 1.74 Allowed 'General case' 0 C--O 1.242 0.662 0 N-CA-C 108.593 -0.892 . . . . 63.13 108.593 -177.548 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.54 -79.11 0.82 Allowed Glycine 0 C--N 1.348 1.242 0 CA-C-N 115.443 -0.799 . . . . 45.22 112.565 -178.197 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -131.98 -18.38 2.67 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.108 0.963 . . . . 72.01 110.994 174.654 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.511 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 7.0 m -85.21 116.74 23.74 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 122.78 0.432 . . . . 75.1 109.889 177.605 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.61 HD12 HG21 ' A' ' 11' ' ' VAL . 32.4 mt -91.0 106.35 17.44 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 N-CA-C 108.988 -0.745 . . . . 61.13 108.988 169.665 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 35.2 mtp180 -89.06 94.46 9.95 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 108.11 -1.07 . . . . 74.22 108.11 175.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.3 t -85.97 114.52 25.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 N-CA-C 108.971 -0.752 . . . . 72.31 108.971 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -84.12 109.63 17.86 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 108.024 -1.102 . . . . 73.24 108.024 172.231 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.5 mp -104.04 169.08 8.71 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 122.974 0.509 . . . . 50.13 110.286 177.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 57.8 tt0 -121.2 105.29 10.44 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.174 0.989 . . . . 75.44 109.151 -175.196 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.2 tt -101.09 110.79 22.85 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 108.102 -1.073 . . . . 74.24 108.102 -177.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 72.4 mtt180 . . . . . 0 N--CA 1.478 0.967 0 C-N-CA 122.756 0.423 . . . . 74.53 110.806 -175.069 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt . . . . . 0 N--CA 1.474 0.765 0 N-CA-C 110.057 -0.349 . . . . 64.44 110.057 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -139.77 118.73 12.56 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 108.483 -0.932 . . . . 55.54 108.483 175.664 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -88.57 138.45 31.42 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 122.791 0.436 . . . . 73.31 111.355 -175.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -123.8 119.41 29.63 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.565 0.746 . . . . 75.43 109.209 178.312 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 28.2 m -86.42 100.13 12.13 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 109.391 -0.596 . . . . 74.1 109.391 175.425 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.467 HG22 HG23 ' A' ' 71' ' ' ILE . 45.9 t -93.31 104.21 15.49 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 N-CA-C 107.48 -1.304 . . . . 71.0 107.48 179.411 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -84.74 101.72 12.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.717 -1.129 . . . . 73.2 108.864 -176.659 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.538 ' HB ' HG13 ' A' ' 11' ' ' VAL . 21.6 t -106.65 111.26 34.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 124.067 0.947 . . . . 63.23 108.517 177.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.511 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 33.8 tt0 -100.97 150.13 23.2 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.523 0.729 . . . . 55.12 110.54 -175.165 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -68.16 106.28 2.36 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.355 0.662 . . . . 65.33 109.653 174.272 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 56.0 tp60 -92.83 85.96 5.35 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 108.43 -0.952 . . . . 73.35 108.43 173.142 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.02 -98.47 0.56 Allowed Glycine 0 C--N 1.348 1.244 0 N-CA-C 111.335 -0.706 . . . . 55.34 111.335 -174.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -101.53 -34.69 9.44 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.076 0.95 . . . . 72.04 109.98 176.598 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 65.0 p -84.87 175.97 8.78 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.827 0.851 . . . . 75.13 111.956 -174.07 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -114.05 139.39 49.33 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.565 1.146 . . . . 71.54 109.895 176.495 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 8.8 t -133.27 132.53 41.52 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.623 0.769 . . . . 73.44 110.109 -179.082 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.432 HG22 HG22 ' A' ' 59' ' ' VAL . 88.8 t -74.77 106.83 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 108.823 -0.806 . . . . 72.54 108.823 173.311 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 2.9 mmmp? -63.46 -52.03 63.16 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.689 1.196 . . . . 73.33 109.857 175.586 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 19.1 tpt180 -175.67 144.43 0.65 Allowed 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.105 -0.952 . . . . 75.11 109.675 178.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.467 HG23 HG22 ' A' ' 57' ' ' VAL . 35.6 mt -88.38 110.56 21.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 N-CA-C 108.194 -1.039 . . . . 53.45 108.194 168.32 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 30.7 m -91.96 106.98 18.88 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.99 -0.745 . . . . 75.3 108.99 177.534 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 52.6 ttt180 -68.82 129.44 39.95 Favored 'General case' 0 C--O 1.244 0.816 0 N-CA-C 108.23 -1.026 . . . . 70.21 108.23 169.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 15.3 t . . . . . 0 C--O 1.246 0.889 0 O-C-N 123.774 0.671 . . . . 62.33 110.857 -179.683 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 . . . . . 0 CA--C 1.546 0.794 0 N-CA-C 111.209 0.077 . . . . 73.3 111.209 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.412 ' O ' HG23 ' A' ' 11' ' ' VAL . 52.0 mt-10 -48.11 -53.57 16.17 Favored 'General case' 0 C--N 1.363 1.179 0 C-N-CA 124.074 0.949 . . . . 63.45 110.127 173.908 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.527 ' HG3' HG11 ' A' ' 33' ' ' VAL . 0.4 OUTLIER -56.22 -45.09 80.06 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 124.905 1.378 . . . . 74.51 109.732 -175.898 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -62.89 -38.12 89.63 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.97 0.908 . . . . 75.02 111.356 -177.27 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -75.02 -44.58 47.17 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.698 0.799 . . . . 55.01 110.9 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.441 HG11 ' HB ' ' A' ' 40' ' ' ILE . 90.6 t -76.41 -32.76 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.179 0.992 . . . . 63.14 112.301 -169.166 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.409 ' HG3' ' O ' ' A' ' 8' ' ' LYS . 9.1 mtmp? -61.32 -37.92 85.0 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 109.685 -0.487 . . . . 74.45 109.685 173.009 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.535 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 57.5 tt0 -67.54 -52.08 43.16 Favored 'General case' 0 C--N 1.352 0.717 0 O-C-N 124.248 0.968 . . . . 71.34 110.123 176.025 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.463 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 72.2 t -54.97 -39.88 51.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 123.223 0.609 . . . . 73.14 110.62 179.736 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.426 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -66.62 -48.42 69.55 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 115.363 -0.835 . . . . 74.11 112.078 -178.79 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -71.34 -34.9 70.94 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 123.713 0.633 . . . . 72.23 111.769 -174.263 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.535 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 20.7 mm-40 -61.63 -43.4 98.92 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 123.404 0.44 . . . . 62.32 110.623 -179.303 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.573 ' HG3' HG21 ' A' ' 68' ' ' VAL . 2.2 mmmp? -64.18 -42.79 96.55 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 123.759 0.662 . . . . 73.42 110.011 178.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.499 ' HB3' HD12 ' A' ' 46' ' ' LEU . 40.5 mt -63.0 -34.89 78.52 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.76 0.824 . . . . 75.32 112.563 177.515 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 85.1 mt -77.21 -26.41 52.7 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.389 0.676 . . . . 74.21 111.62 -177.01 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 12.5 mm-40 -69.87 -36.62 75.63 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 109.909 -0.404 . . . . 74.4 109.909 171.803 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -77.28 -31.37 54.77 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.312 1.045 . . . . 71.02 111.462 178.265 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.9 m -146.28 83.15 8.61 Favored Pre-proline 0 CA--C 1.56 1.35 0 C-N-CA 123.705 0.802 . . . . 72.14 109.935 -174.494 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -75.71 -21.26 14.75 Favored 'Trans proline' 0 C--N 1.375 1.951 0 C-N-CA 123.138 2.558 . . . . 64.41 112.127 177.249 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -86.57 15.28 5.71 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.326 1.05 . . . . 53.4 111.18 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 46.9 t -120.2 152.78 37.21 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.476 0.711 . . . . 62.11 111.207 -176.528 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.89 108.96 20.73 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 107.73 -1.211 . . . . 75.02 107.73 174.339 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.3 t -97.46 116.83 40.92 Favored 'Isoleucine or valine' 0 C--O 1.239 0.552 0 C-N-CA 123.508 0.723 . . . . 71.01 110.061 -176.264 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -101.59 161.94 13.27 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.578 1.151 . . . . 74.22 108.345 171.501 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 59.2 t -87.48 113.85 25.48 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 N-CA-C 107.834 -1.173 . . . . 51.42 107.834 169.501 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -81.89 -45.27 15.7 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.397 0.679 . . . . 63.4 110.111 -176.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 29.8 tpt180 -167.66 157.01 10.01 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 124.03 0.932 . . . . 65.14 109.145 177.53 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.527 HG11 ' HG3' ' A' ' 8' ' ' LYS . 58.0 t -120.87 130.58 74.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 123.464 0.706 . . . . 74.04 109.374 176.256 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 84.2 mm-40 -119.62 112.18 19.0 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.728 0.811 . . . . 75.13 109.706 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.549 ' HG2' HG12 ' A' ' 40' ' ' ILE . 3.6 tmtp? -92.06 107.4 19.18 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 106.747 -1.575 . . . . 74.01 106.747 173.853 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -119.55 101.58 8.03 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 108.522 -0.918 . . . . 75.5 108.522 -174.854 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.19 -93.72 0.52 Allowed Glycine 0 C--N 1.348 1.242 0 O-C-N 123.585 0.553 . . . . 40.33 112.488 -176.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -135.55 5.86 3.2 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.343 1.057 . . . . 64.03 109.26 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 69.3 m -118.67 116.16 26.01 Favored 'General case' 0 C--O 1.241 0.628 0 C-N-CA 124.69 1.196 . . . . 74.13 109.621 -177.585 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.549 HG12 ' HG2' ' A' ' 35' ' ' LYS . 35.0 mt -88.8 108.14 18.59 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-O 121.037 0.446 . . . . 75.01 110.119 178.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -86.17 95.22 9.5 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.403 1.081 . . . . 74.23 108.172 174.375 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 25.9 t -85.46 122.92 38.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 N-CA-C 109.13 -0.692 . . . . 61.33 109.13 178.479 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -87.24 121.21 29.39 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 108.007 -1.109 . . . . 75.13 108.007 170.41 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.8 mp -120.08 151.2 39.39 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-O 121.122 0.486 . . . . 73.12 109.917 179.289 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.507 ' HG3' ' HG3' ' A' ' 52' ' ' LYS . 39.3 tt0 -106.31 102.5 11.9 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 107.77 -1.196 . . . . 42.14 107.77 -179.648 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.499 HD12 ' HB3' ' A' ' 19' ' ' LEU . 8.8 tt -102.0 112.16 24.7 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.146 -1.057 . . . . 73.5 108.146 -174.558 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 . . . . . 0 N--CA 1.478 0.957 0 C-N-CA 123.273 0.629 . . . . 72.32 110.181 -169.513 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.507 ' HG3' ' HG3' ' A' ' 45' ' ' GLU . 39.8 ttmt . . . . . 0 C--O 1.245 0.838 0 N-CA-C 108.259 -1.015 . . . . 72.21 108.259 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -102.37 112.53 25.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.975 -1.011 . . . . 73.24 108.451 179.549 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -92.0 115.2 27.86 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 109.058 -0.719 . . . . 63.1 109.058 -177.038 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -108.45 121.1 44.25 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.627 0.771 . . . . 55.11 109.359 179.321 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 35.0 m -90.93 100.83 13.62 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 108.265 -1.013 . . . . 73.23 108.265 169.819 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.448 HG13 HG12 ' A' ' 71' ' ' ILE . 47.3 t -93.66 103.41 14.66 Favored 'Isoleucine or valine' 0 C--O 1.241 0.656 0 N-CA-C 107.326 -1.361 . . . . 75.25 107.326 177.369 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -87.59 100.8 13.06 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.439 -0.8 . . . . 73.23 108.871 -176.689 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.446 HG22 HG22 ' A' ' 68' ' ' VAL . 25.5 t -104.45 116.1 47.62 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 124.113 0.965 . . . . 63.11 109.165 -177.511 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -100.78 143.53 30.83 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.246 1.018 . . . . 63.51 109.947 -175.652 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.7 tpp180 -71.36 134.19 46.52 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.163 0.585 . . . . 62.42 110.602 176.309 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -133.05 89.84 2.67 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 108.274 -1.01 . . . . 61.12 108.274 172.433 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 68.26 -111.26 3.89 Favored Glycine 0 C--N 1.35 1.323 0 CA-C-N 114.813 -1.085 . . . . 73.34 112.325 -177.624 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -92.26 -25.68 18.5 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.287 0.635 . . . . 74.11 111.089 178.831 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 22.9 p -99.12 175.76 5.79 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.917 0.887 . . . . 75.22 111.847 -175.374 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -123.57 158.52 31.22 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.522 1.129 . . . . 62.35 109.761 179.312 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 9.0 t -145.46 135.3 23.55 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.494 0.318 . . . . 72.2 110.725 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.573 HG21 ' HG3' ' A' ' 18' ' ' LYS . 91.3 t -77.86 115.47 19.89 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 N-CA-C 109.227 -0.657 . . . . 44.43 109.227 173.888 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -80.92 -41.89 22.24 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 123.24 0.616 . . . . 75.22 110.632 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -165.38 144.35 6.42 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 123.462 0.705 . . . . 73.35 110.261 175.478 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.448 HG12 HG13 ' A' ' 57' ' ' VAL . 41.8 mt -104.25 107.66 22.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 N-CA-C 108.027 -1.101 . . . . 63.03 108.027 168.322 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.0 m -107.76 108.39 19.58 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.204 0.602 . . . . 74.14 109.676 -178.935 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 -79.29 150.01 31.63 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 109.579 -0.526 . . . . 74.12 109.579 172.518 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.3 t . . . . . 0 CA--C 1.554 1.12 0 CA-C-N 115.656 -0.702 . . . . 63.13 109.951 172.544 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 . . . . . 0 N--CA 1.469 0.479 0 N-CA-C 110.085 -0.339 . . . . 74.4 110.085 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.555 ' O ' HG23 ' A' ' 11' ' ' VAL . 39.9 mm-40 -55.04 -45.91 75.26 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 124.258 0.974 . . . . 74.24 111.895 175.82 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -62.2 -36.57 82.33 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 122.898 0.479 . . . . 74.01 111.389 -178.464 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.405 ' HA ' ' HE3' ' A' ' 12' ' ' LYS . 43.5 mtp180 -63.73 -38.96 93.05 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 115.557 -0.747 . . . . 74.44 109.797 179.172 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.5 mt-30 -66.59 -40.93 89.13 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 114.753 -1.112 . . . . 73.12 110.875 176.342 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 7' ' ' GLU . 63.0 t -61.05 -44.78 98.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 123.434 0.694 . . . . 71.54 111.9 -175.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.405 ' HE3' ' HA ' ' A' ' 9' ' ' ARG . 10.1 mtmp? -60.92 -32.69 72.17 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 123.732 0.645 . . . . 72.45 110.724 179.65 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.511 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.9 tt0 -71.68 -53.78 12.45 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 115.361 -0.836 . . . . 70.33 110.323 176.371 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.402 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 98.5 t -53.91 -36.27 30.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 C-N-CA 123.598 0.759 . . . . 72.34 110.759 179.387 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.466 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -66.85 -50.95 60.9 Favored 'General case' 0 C--O 1.247 0.924 0 CA-C-N 114.795 -1.093 . . . . 43.25 111.454 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.45 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 20.5 ptmt -69.46 -33.08 72.38 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 116.18 -0.464 . . . . 73.23 111.925 -175.133 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.511 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 19.3 mm-40 -61.86 -43.0 99.72 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 123.691 0.619 . . . . 72.45 110.122 -179.114 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.432 ' HG3' HG21 ' A' ' 68' ' ' VAL . 14.9 mmmm -73.88 -22.43 59.73 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 115.603 -0.726 . . . . 62.15 111.143 -178.748 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 57.9 mt -73.9 -36.22 64.73 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 122.852 0.461 . . . . 65.34 111.541 169.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 83.6 mt -66.12 -32.15 73.44 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.627 0.771 . . . . 63.45 110.77 178.445 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -57.19 -41.31 79.08 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.918 0.887 . . . . 71.33 110.962 174.73 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -80.75 -51.72 8.34 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.488 -0.778 . . . . 73.2 110.824 -177.003 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 27.1 t -131.11 89.4 42.14 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 123.277 0.631 . . . . 64.13 109.927 -175.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -80.06 -1.93 11.73 Favored 'Trans proline' 0 C--N 1.375 1.965 0 C-N-CA 122.989 2.459 . . . . 73.41 112.592 174.448 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -86.56 6.55 30.19 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.964 0.906 . . . . 75.31 111.832 -178.619 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 21.5 p -143.72 141.98 30.73 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.514 0.726 . . . . 65.22 110.644 -171.72 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -86.72 136.63 32.94 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 108.342 -0.985 . . . . 72.53 108.342 174.72 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.508 HG22 HD12 ' A' ' 46' ' ' LEU . 40.7 t -98.61 117.18 43.21 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 C-N-CA 123.114 0.566 . . . . 73.45 110.236 -174.069 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 54.4 tp60 -91.71 147.57 22.9 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.806 1.243 . . . . 75.21 109.168 175.363 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 79.9 t -87.92 121.2 38.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 N-CA-C 108.343 -0.984 . . . . 61.54 108.343 170.279 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.3 tpt180 -94.72 -59.62 1.88 Allowed 'General case' 0 N--CA 1.477 0.88 0 O-C-N 123.295 0.372 . . . . 74.31 110.242 -178.111 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 50.3 mtt180 -148.53 165.2 31.93 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 124.321 1.048 . . . . 73.43 110.166 -179.622 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 82.0 t -137.16 132.78 46.87 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 C-N-CA 124.346 1.059 . . . . 73.24 109.127 178.818 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.414 ' HB2' ' HB2' ' A' ' 41' ' ' ARG . 69.2 mm-40 -125.46 108.57 11.76 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.332 1.053 . . . . 73.5 108.814 -177.213 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.5 tmtt? -92.87 106.92 18.81 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 108.042 -1.096 . . . . 70.2 108.042 -176.636 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.2 mm-40 -120.51 89.01 3.04 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.443 0.697 . . . . 73.33 109.791 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.6 -98.58 0.41 Allowed Glycine 0 C--N 1.35 1.339 0 CA-C-N 115.598 -0.728 . . . . 72.33 112.501 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -105.87 -26.16 11.84 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.738 0.815 . . . . 70.12 110.349 175.125 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 25.1 m -87.77 98.68 11.59 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.406 0.683 . . . . 74.31 110.475 -177.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.523 HD12 HG21 ' A' ' 11' ' ' VAL . 40.1 mt -90.12 108.47 19.51 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 CA-C-N 116.085 -0.507 . . . . 72.35 109.867 171.692 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.584 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 91.6 mtt180 -84.12 105.8 15.27 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.402 1.081 . . . . 65.04 109.388 174.44 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.1 t -95.19 118.94 42.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 N-CA-C 108.721 -0.844 . . . . 54.24 108.721 174.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -83.74 115.24 22.11 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 107.992 -1.114 . . . . 75.13 107.992 168.271 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.445 HD11 ' HB1' ' A' ' 15' ' ' ALA . 2.7 mp -108.71 170.83 7.78 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.887 -0.783 . . . . 53.5 108.887 174.355 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -135.75 107.68 7.11 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.862 -0.792 . . . . 74.52 108.862 -168.305 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.508 HD12 HG22 ' A' ' 28' ' ' VAL . 9.2 tt -127.71 138.15 52.69 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.831 1.252 . . . . 75.44 108.697 -168.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 48.9 mtm105 . . . . . 0 N--CA 1.478 0.94 0 C-N-CA 122.828 0.451 . . . . 72.04 110.923 -175.421 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.543 0.701 0 N-CA-C 108.209 -1.034 . . . . 53.44 108.209 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -120.51 127.82 52.54 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.773 1.229 . . . . 74.22 109.091 178.385 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -88.58 130.02 35.35 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 109.163 -0.681 . . . . 73.33 109.163 175.628 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -114.22 118.71 34.74 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 109.279 -0.637 . . . . 72.45 109.279 178.295 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 38.4 m -86.16 100.7 12.4 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 108.458 -0.942 . . . . 75.42 108.458 172.367 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.466 HG11 ' HA ' ' A' ' 15' ' ' ALA . 60.1 t -92.91 106.52 18.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 N-CA-C 108.411 -0.959 . . . . 72.45 108.411 178.713 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.584 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 33.1 mt-10 -77.31 107.6 9.83 Favored 'General case' 0 C--O 1.222 -0.353 0 N-CA-C 108.056 -1.09 . . . . 63.51 108.056 178.213 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.521 HG22 HG22 ' A' ' 68' ' ' VAL . 38.8 t -112.14 124.38 68.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 N-CA-C 109.006 -0.739 . . . . 72.42 109.006 176.894 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -112.92 147.51 36.92 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.499 0.719 . . . . 72.24 110.128 -177.421 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -74.96 106.78 6.63 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.372 -0.831 . . . . 75.23 110.357 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 22.7 tp60 -91.22 79.12 5.73 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 108.388 -0.968 . . . . 75.0 108.388 174.32 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 73.24 -100.53 1.05 Allowed Glycine 0 C--N 1.348 1.215 0 CA-C-N 114.986 -1.006 . . . . 74.33 112.366 -179.615 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -95.0 -32.2 13.26 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.142 0.977 . . . . 52.12 110.265 176.255 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.8 p -96.08 176.46 6.08 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.687 0.795 . . . . 63.11 111.358 -175.329 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' TRP . . . . . 0.427 ' HZ2' ' HB3' ' A' ' 7' ' ' GLU . 96.3 m95 -119.08 149.07 42.3 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.844 1.258 . . . . 72.5 109.934 179.21 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 14.9 t -147.92 140.19 24.31 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.276 0.63 . . . . 65.32 110.281 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.521 HG22 HG22 ' A' ' 59' ' ' VAL . 76.4 t -80.78 114.15 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 123.047 0.539 . . . . 72.24 110.815 -177.503 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -65.41 -54.75 24.18 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.743 1.217 . . . . 74.41 110.85 175.435 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 2.3 tpm_? -163.36 132.18 3.92 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.608 -0.723 . . . . 74.23 110.012 -178.26 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.413 HG12 HG13 ' A' ' 57' ' ' VAL . 63.5 mt -87.76 107.4 17.29 Favored 'Isoleucine or valine' 0 C--O 1.24 0.568 0 N-CA-C 107.828 -1.175 . . . . 64.54 107.828 167.905 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 22.2 m -98.48 115.5 28.68 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.112 -0.949 . . . . 74.43 108.773 -178.677 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 11.8 ttm180 -69.49 149.31 48.4 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 108.883 -0.784 . . . . 75.31 108.883 171.61 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 8.1 t . . . . . 0 C--O 1.245 0.867 0 C-N-CA 123.0 0.52 . . . . 73.44 110.307 173.495 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 . . . . . 0 N--CA 1.48 1.046 0 N-CA-C 111.822 0.305 . . . . 64.4 111.822 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -46.28 -53.23 11.11 Favored 'General case' 0 C--O 1.209 -1.037 0 C-N-CA 123.764 0.825 . . . . 74.52 109.948 165.766 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.658 ' HG3' HG11 ' A' ' 33' ' ' VAL . 1.1 mptm? -58.57 -45.34 89.2 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.312 1.045 . . . . 75.14 111.208 179.478 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 28.3 mmm180 -55.97 -42.24 75.98 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.857 0.863 . . . . 74.34 110.881 -177.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -78.57 -55.13 5.44 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 114.773 -1.103 . . . . 52.34 111.34 -178.302 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.426 HG12 HG21 ' A' ' 42' ' ' VAL . 73.9 t -65.81 -37.58 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 124.842 1.257 . . . . 73.24 113.218 -166.213 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.473 ' HD2' HG21 ' A' ' 30' ' ' VAL . 22.3 mtmm -64.01 -38.12 89.92 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-N 118.163 0.438 . . . . 75.41 109.903 178.463 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.537 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.5 tt0 -69.05 -45.53 70.18 Favored 'General case' 0 C--N 1.352 0.679 0 CA-C-N 115.349 -0.841 . . . . 64.44 110.494 178.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.484 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 92.8 t -60.19 -41.51 86.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 123.228 0.611 . . . . 73.44 109.99 177.205 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.76 -39.08 76.92 Favored 'General case' 0 C--O 1.244 0.769 0 C-N-CA 124.213 1.005 . . . . 75.51 111.927 -176.545 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.454 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 21.6 ptmt -71.87 -30.89 65.9 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 119.297 -0.383 . . . . 43.54 110.566 -179.128 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 24.4 mm-40 -61.91 -41.77 98.31 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 123.609 0.568 . . . . 74.44 110.4 174.232 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.648 ' HB3' HD11 ' A' ' 71' ' ' ILE . 2.1 mmmp? -61.41 -36.54 80.6 Favored 'General case' 0 CA--C 1.55 0.948 0 O-C-N 124.048 0.842 . . . . 73.34 110.507 178.593 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.593 ' HB3' HD12 ' A' ' 46' ' ' LEU . 52.0 mt -76.07 -31.91 59.0 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.788 0.835 . . . . 73.33 112.436 177.276 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 93.3 mt -73.11 -25.44 60.86 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.987 0.515 . . . . 62.44 110.902 178.619 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 49.5 mt-10 -65.11 -42.71 93.71 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-O 121.293 0.568 . . . . 73.1 110.149 171.82 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -71.37 -36.3 71.4 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 115.044 -0.98 . . . . 71.53 111.238 178.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.2 t -148.88 89.75 4.91 Favored Pre-proline 0 CA--C 1.544 0.716 0 CA-C-N 115.836 -0.62 . . . . 71.24 109.688 -175.261 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -70.37 -17.46 34.78 Favored 'Trans proline' 0 C--N 1.377 2.034 0 C-N-CA 122.828 2.352 . . . . 61.23 111.609 172.616 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -79.59 -10.73 59.85 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.338 1.055 . . . . 61.43 112.099 -176.315 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 68.7 p -104.8 157.0 17.5 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.514 0.726 . . . . 72.1 111.672 -178.32 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.504 ' HE3' ' HA ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -102.86 124.18 47.91 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 108.353 -0.98 . . . . 62.42 108.353 164.626 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.402 HG11 HD12 ' A' ' 19' ' ' LEU . 49.4 t -101.4 114.22 39.96 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 123.796 0.838 . . . . 72.54 109.958 -178.363 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -93.53 165.11 12.91 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 124.322 1.049 . . . . 74.31 108.693 171.584 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.473 HG21 ' HD2' ' A' ' 12' ' ' LYS . 4.0 p -81.92 132.5 31.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 N-CA-C 109.0 -0.741 . . . . 60.21 109.0 165.203 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.403 ' HG2' ' ND2' ' A' ' 54' ' ' ASN . 19.7 tpt180 -100.93 -44.21 5.82 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.362 0.665 . . . . 72.2 109.933 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -167.67 151.02 6.11 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 108.024 -1.102 . . . . 64.22 108.024 -175.039 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.658 HG11 ' HG3' ' A' ' 8' ' ' LYS . 65.8 t -129.62 130.77 67.11 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 123.487 0.715 . . . . 60.33 109.297 176.163 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -121.88 108.11 13.07 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.06 0.944 . . . . 70.11 109.801 177.054 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -92.17 109.68 21.05 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 108.395 -0.965 . . . . 74.34 108.395 171.771 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -122.52 90.13 3.24 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.768 0.827 . . . . 64.44 109.598 -178.108 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.26 -85.38 0.1 Allowed Glycine 0 C--N 1.348 1.2 0 CA-C-N 115.78 -0.645 . . . . 54.53 114.218 173.596 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -118.2 4.44 11.95 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 124.303 1.041 . . . . 64.0 111.869 -176.092 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 47.5 m -142.18 119.47 11.51 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.815 0.446 . . . . 62.15 111.043 -174.57 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.405 HD12 HG21 ' A' ' 11' ' ' VAL . 24.5 mt -94.75 108.12 20.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 123.171 0.588 . . . . 53.14 109.758 171.763 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 11.9 mtm180 -90.12 99.98 12.89 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 107.365 -1.346 . . . . 73.25 107.365 174.196 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.439 HG13 HG22 ' A' ' 33' ' ' VAL . 40.5 t -91.07 116.53 32.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 N-CA-C 108.911 -0.774 . . . . 75.35 108.911 178.228 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -79.15 127.04 31.52 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 107.652 -1.24 . . . . 74.31 107.652 167.085 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.8 mp -124.22 154.42 40.18 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 109.386 -0.598 . . . . 73.4 109.386 177.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -107.27 104.5 14.13 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 108.932 -0.766 . . . . 74.43 108.932 -177.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.593 HD12 ' HB3' ' A' ' 19' ' ' LEU . 9.5 tt -100.76 126.53 47.32 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 108.244 -1.021 . . . . 64.21 108.244 -178.915 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 . . . . . 0 N--CA 1.485 1.282 0 C-N-CA 122.884 0.473 . . . . 74.14 110.949 -173.672 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt . . . . . 0 N--CA 1.468 0.468 0 N-CA-C 109.313 -0.625 . . . . 72.52 109.313 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -145.29 127.87 16.1 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 108.597 -0.89 . . . . 62.04 108.597 174.572 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.403 ' ND2' ' HG2' ' A' ' 31' ' ' ARG . 3.1 m-20 -86.85 143.04 27.63 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.975 0.91 . . . . 63.51 109.3 -178.529 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -132.07 120.25 22.11 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.018 0.527 . . . . 72.43 110.007 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 91.0 m -84.98 100.29 11.56 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 108.825 -0.805 . . . . 62.11 108.825 170.724 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 71.2 t -93.02 103.86 15.12 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 N-CA-C 107.047 -1.464 . . . . 71.24 107.047 174.6 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.434 ' HB2' ' HB2' ' A' ' 69' ' ' LYS . 41.1 mt-10 -79.41 114.58 18.46 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 114.917 -1.038 . . . . 75.34 108.583 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.4 HG22 HG22 ' A' ' 68' ' ' VAL . 44.5 t -115.73 122.2 68.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 124.047 0.939 . . . . 62.44 108.61 177.702 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.474 ' HB2' ' HD3' ' A' ' 69' ' ' LYS . 35.9 tt0 -100.59 144.68 29.28 Favored 'General case' 0 C--O 1.241 0.653 0 C-N-CA 124.426 1.09 . . . . 75.12 109.827 -173.399 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 26.0 tpt180 -80.73 105.5 12.01 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.388 0.675 . . . . 74.53 109.447 174.59 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -108.12 89.47 3.01 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.375 1.07 . . . . 73.41 108.208 179.079 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 71.0 -107.51 2.19 Favored Glycine 0 CA--C 1.529 0.965 0 N-CA-C 111.693 -0.563 . . . . 71.44 111.693 -174.302 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -113.6 -3.57 13.6 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.882 0.873 . . . . 73.43 109.99 174.818 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 32.8 p -99.02 172.55 7.33 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.329 0.585 . . . . 74.3 111.096 176.666 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -119.49 140.72 50.02 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.876 1.27 . . . . 71.04 109.227 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 9.0 t -140.28 124.32 17.54 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 121.196 0.522 . . . . 73.32 110.453 -178.284 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.4 HG22 HG22 ' A' ' 59' ' ' VAL . 90.0 t -75.28 114.36 15.24 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 C-N-CA 123.287 0.635 . . . . 65.1 110.17 -177.868 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.474 ' HD3' ' HB2' ' A' ' 60' ' ' GLU . 32.1 mmmt -64.93 -50.4 66.61 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.626 1.171 . . . . 52.21 110.43 176.208 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -170.37 165.1 8.8 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 124.508 1.13 . . . . 72.45 110.035 175.022 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.648 HD11 ' HB3' ' A' ' 18' ' ' LYS . 75.1 mt -101.44 107.22 20.99 Favored 'Isoleucine or valine' 0 C--O 1.24 0.593 0 N-CA-C 107.491 -1.299 . . . . 70.42 107.491 166.038 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 12.3 m -92.87 114.58 27.18 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 109.299 -0.63 . . . . 75.11 109.299 -178.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 -68.05 141.47 56.16 Favored 'General case' 0 C--O 1.245 0.816 0 N-CA-C 109.037 -0.727 . . . . 72.45 109.037 169.778 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.5 t . . . . . 0 C--O 1.245 0.845 0 N-CA-C 109.112 -0.699 . . . . 71.21 109.112 173.993 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 . . . . . 0 CA--C 1.535 0.38 0 CA-C-O 119.664 -0.208 . . . . 73.23 111.138 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -56.69 -44.08 81.13 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.333 0.653 . . . . 54.12 110.309 174.123 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.4 ' O ' ' HG3' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -64.67 -45.47 86.58 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 124.059 0.849 . . . . 75.03 108.977 177.592 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 21.7 mtm180 -58.25 -40.02 80.68 Favored 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 123.866 0.866 . . . . 75.54 111.649 -178.587 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -67.57 -55.12 14.66 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.128 0.971 . . . . 74.01 110.314 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.602 HG21 HD12 ' A' ' 40' ' ' ILE . 72.4 t -64.97 -36.31 77.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 123.811 0.844 . . . . 74.4 112.436 -172.504 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 8' ' ' LYS . 10.3 mtmp? -65.4 -42.63 92.39 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.658 0.383 . . . . 72.11 110.26 176.362 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.501 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.2 tt0 -66.09 -49.29 68.1 Favored 'General case' 0 C--N 1.352 0.691 0 O-C-N 123.866 0.729 . . . . 64.11 110.217 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.484 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 84.6 t -57.87 -46.23 87.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 123.232 0.613 . . . . 74.43 109.862 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.449 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -60.25 -51.61 68.84 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.77 0.828 . . . . 52.03 112.295 -178.305 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -63.4 -39.5 94.67 Favored 'General case' 0 C--N 1.351 0.633 0 O-C-N 123.924 0.765 . . . . 73.32 110.406 -178.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 33.4 mm-40 -66.59 -40.66 89.0 Favored 'General case' 0 C--N 1.353 0.748 0 O-C-N 123.409 0.443 . . . . 73.53 110.975 178.479 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.484 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 73.4 mmtt -64.17 -35.31 80.38 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.484 0.714 . . . . 64.43 110.95 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.614 ' HB3' HD12 ' A' ' 46' ' ' LEU . 61.5 mt -75.5 -30.44 59.85 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.627 -0.715 . . . . 75.11 111.545 175.686 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.0 mt -73.29 -28.4 62.09 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.523 0.729 . . . . 72.5 110.978 174.818 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 24.4 mm-40 -59.24 -36.35 75.29 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 123.29 0.636 . . . . 75.32 110.172 174.458 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -91.83 -30.4 16.22 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 114.444 -1.253 . . . . 61.44 111.199 -175.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.2 t -148.81 88.33 5.24 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 122.82 0.448 . . . . 52.14 110.685 -175.485 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -76.04 -20.91 14.46 Favored 'Trans proline' 0 C--N 1.383 2.359 0 C-N-CA 123.155 2.57 . . . . 75.42 113.367 178.42 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -78.31 -13.18 59.96 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.346 0.658 . . . . 74.11 111.733 -176.505 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 54.0 p -105.87 135.5 47.18 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.577 0.751 . . . . 33.01 110.487 177.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -75.06 126.61 31.38 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 108.708 -0.849 . . . . 55.22 108.708 167.414 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 58.6 t -100.85 112.91 35.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 109.421 -0.585 . . . . 62.04 109.421 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.512 ' HB2' ' HB3' ' A' ' 45' ' ' GLU . 15.8 mm100 -100.0 123.76 44.61 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.909 1.284 . . . . 74.32 109.397 -178.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 p -64.88 115.78 3.52 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 N-CA-C 109.121 -0.696 . . . . 51.31 109.121 173.59 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 -96.53 -42.14 8.22 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.716 -0.675 . . . . 73.05 110.25 -171.762 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.473 ' HB3' ' HB2' ' A' ' 43' ' ' GLU . 60.6 ttt180 -154.71 143.79 21.05 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.463 0.705 . . . . 72.11 110.181 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.8 t -114.63 110.69 32.97 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 N-CA-C 107.982 -1.118 . . . . 71.23 107.982 173.253 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 23.7 tp60 -125.7 117.07 22.69 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 118.162 0.437 . . . . 61.23 111.308 -174.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.6 tppp? -78.23 134.66 37.55 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.905 0.882 . . . . 44.03 110.59 178.564 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 18.9 mm100 -128.43 84.05 2.21 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.365 1.066 . . . . 73.53 108.331 170.44 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.43 -93.18 0.7 Allowed Glycine 0 C--N 1.35 1.344 0 CA-C-N 115.83 -0.623 . . . . 74.24 111.618 -175.312 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.498 ' HB3' ' HB3' ' A' ' 61' ' ' ARG . 3.9 m-20 -119.27 -13.07 9.34 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 123.557 0.743 . . . . 65.23 110.299 173.3 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.617 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 21.2 m -91.84 99.25 12.15 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 123.685 0.794 . . . . 72.04 110.177 -179.178 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.602 HD12 HG21 ' A' ' 11' ' ' VAL . 37.9 mt -76.55 107.77 8.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 N-CA-C 108.988 -0.745 . . . . 74.3 108.988 175.071 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.474 HH21 HG21 ' A' ' 56' ' ' THR . 54.0 mtp180 -83.68 95.4 8.37 Favored 'General case' 0 C--O 1.24 0.603 0 N-CA-C 107.508 -1.293 . . . . 73.22 107.508 169.133 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.419 HG21 ' HB2' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -85.02 123.31 39.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 N-CA-C 108.685 -0.857 . . . . 71.11 108.685 173.948 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.473 ' HB2' ' HB3' ' A' ' 32' ' ' ARG . 45.0 mt-10 -89.33 130.51 35.7 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 123.943 0.897 . . . . 63.23 108.748 170.367 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.2 mp -130.2 168.68 16.44 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.214 0.53 . . . . 72.24 110.108 179.137 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.512 ' HB3' ' HB2' ' A' ' 29' ' ' GLN . 31.1 tt0 -118.24 119.33 34.36 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 125.455 1.502 . . . . 72.31 108.508 -174.177 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.614 HD12 ' HB3' ' A' ' 19' ' ' LEU . 8.1 tt -133.36 129.85 38.01 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.077 -1.453 . . . . 75.14 107.077 -176.867 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 50.8 mtp180 . . . . . 0 CA--C 1.54 0.589 0 C-N-CA 123.147 0.579 . . . . 73.23 109.882 -175.827 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt . . . . . 0 N--CA 1.475 0.808 0 CA-C-O 120.69 0.281 . . . . 61.5 111.172 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.551 ' HG2' ' HD2' ' A' ' 73' ' ' ARG . 13.2 mp0 -105.11 143.37 33.38 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.055 0.942 . . . . 62.32 110.299 179.7 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -93.96 131.63 39.22 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 108.949 -0.76 . . . . 74.42 108.949 173.238 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.534 ' CE2' ' HB3' ' A' ' 46' ' ' LEU . 20.9 m-85 -120.44 121.45 38.55 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.535 0.734 . . . . 74.41 109.726 178.466 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.474 HG21 HH21 ' A' ' 41' ' ' ARG . 25.1 m -87.63 103.88 15.99 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.757 0.823 . . . . 33.51 109.455 173.56 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.449 HG11 ' HA ' ' A' ' 15' ' ' ALA . 48.9 t -93.74 105.26 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 N-CA-C 107.55 -1.278 . . . . 54.45 107.55 172.621 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -88.49 100.11 12.81 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 108.407 -0.961 . . . . 64.03 108.407 -177.441 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.573 HG22 HG22 ' A' ' 68' ' ' VAL . 29.1 t -104.03 118.92 51.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 123.792 0.837 . . . . 63.52 108.948 -178.63 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.617 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 31.0 tt0 -101.07 146.47 27.4 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.089 0.956 . . . . 64.3 110.114 -177.432 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.498 ' HB3' ' HB3' ' A' ' 38' ' ' ASN . 7.7 tpp180 -74.31 142.16 45.21 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 116.158 -0.474 . . . . 71.11 110.106 173.416 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -142.61 83.3 1.81 Allowed 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 108.123 -1.066 . . . . 71.21 108.123 175.043 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.21 -104.07 1.2 Allowed Glycine 0 C--N 1.345 1.08 0 CA-C-N 115.33 -0.85 . . . . 62.44 112.032 -176.213 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -101.84 -19.18 15.41 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.123 0.569 . . . . 62.14 111.091 179.468 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.6 t -100.25 172.9 6.88 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 122.869 0.468 . . . . 74.1 111.319 -176.359 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -123.08 120.96 34.83 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.605 1.162 . . . . 72.43 109.208 179.119 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.9 t -111.97 120.5 42.12 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 123.918 0.887 . . . . 72.41 110.484 179.582 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.573 HG22 HG22 ' A' ' 59' ' ' VAL . 58.9 t -74.81 120.18 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 N-CA-C 109.68 -0.489 . . . . 70.15 109.68 179.092 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.412 ' HA ' ' HE2' ' A' ' 69' ' ' LYS . 11.5 mmpt? -76.59 -55.59 5.38 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.394 1.077 . . . . 71.21 110.923 -179.352 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 23.2 ttt85 -163.68 125.73 2.46 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.687 -0.688 . . . . 75.3 110.412 -172.724 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.456 HD11 ' HB3' ' A' ' 18' ' ' LYS . 57.1 mt -93.35 131.05 41.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 N-CA-C 107.917 -1.142 . . . . 73.04 107.917 167.5 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 84.7 m -137.91 125.48 22.14 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 123.516 0.726 . . . . 61.24 109.689 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.551 ' HD2' ' HG2' ' A' ' 53' ' ' GLU . 36.7 ttp85 -75.37 144.65 42.19 Favored 'General case' 0 C--O 1.242 0.701 0 N-CA-C 108.43 -0.952 . . . . 72.14 108.43 170.126 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.3 t . . . . . 0 C--O 1.249 1.073 0 C-N-CA 123.478 0.711 . . . . 73.24 109.55 172.516 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 . . . . . 0 N--CA 1.479 1.005 0 N-CA-C 109.912 -0.403 . . . . 72.23 109.912 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.548 ' O ' HG23 ' A' ' 11' ' ' VAL . 29.6 mm-40 -67.48 -49.47 63.4 Favored 'General case' 0 C--N 1.35 0.599 0 CA-C-O 118.604 -0.712 . . . . 75.3 110.413 -179.503 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.68 ' HG3' HD13 ' A' ' 40' ' ' ILE . 4.0 mppt? -57.16 -37.33 71.92 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-N 118.228 0.467 . . . . 53.33 111.321 175.267 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.585 ' HA ' ' HE2' ' A' ' 12' ' ' LYS . 77.0 ttt180 -59.51 -43.53 93.37 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 123.642 0.589 . . . . 75.05 110.772 177.902 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.484 ' O ' HG23 ' A' ' 14' ' ' VAL . 49.4 mt-30 -64.76 -43.67 92.57 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 115.122 -0.945 . . . . 72.23 110.53 175.203 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.548 HG23 ' O ' ' A' ' 7' ' ' GLU . 74.7 t -62.81 -39.07 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 C-N-CA 124.499 1.12 . . . . 65.51 111.961 -176.27 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.585 ' HE2' ' HA ' ' A' ' 9' ' ' ARG . 49.7 mtmt -64.55 -36.16 83.31 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.291 0.637 . . . . 63.4 110.57 178.854 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.521 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.6 tt0 -67.09 -49.11 66.1 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 124.067 0.854 . . . . 70.45 109.889 175.399 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 10' ' ' GLN . 61.3 t -59.06 -32.42 47.81 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 123.387 0.675 . . . . 74.11 110.571 178.398 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.466 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -73.15 -49.36 28.68 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.254 1.021 . . . . 65.32 111.975 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -68.95 -36.64 78.15 Favored 'General case' 0 N--CA 1.479 1.008 0 O-C-N 123.753 0.658 . . . . 75.43 111.416 -173.731 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.521 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 16.0 mm-40 -64.65 -39.76 94.27 Favored 'General case' 0 C--N 1.353 0.719 0 O-C-N 123.711 0.632 . . . . 74.11 110.821 -177.91 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.405 ' HG3' HG21 ' A' ' 68' ' ' VAL . 14.8 mmmm -73.76 -29.92 62.49 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.122 0.569 . . . . 75.13 111.52 -178.837 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.497 ' HB3' HD12 ' A' ' 46' ' ' LEU . 64.7 mt -71.09 -32.17 68.73 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.041 0.537 . . . . 62.5 111.41 171.215 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.9 mt -71.02 -32.42 69.18 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.306 0.642 . . . . 72.33 110.222 173.091 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 21.8 mm-40 -61.86 -44.53 96.64 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.147 0.579 . . . . 71.24 110.306 176.08 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -71.01 -42.91 68.96 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.109 -0.95 . . . . 61.34 111.457 -179.147 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.9 t -138.82 91.74 11.62 Favored Pre-proline 0 C--O 1.241 0.632 0 CA-C-N 116.03 -0.532 . . . . 74.11 110.483 -177.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -72.33 -12.38 27.45 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 122.925 2.417 . . . . 73.33 111.539 165.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -69.98 -25.06 63.44 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 124.685 1.194 . . . . 73.02 111.236 177.844 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 7.4 m -116.95 146.25 43.11 Favored 'General case' 0 C--O 1.239 0.548 0 C-N-CA 123.705 0.802 . . . . 73.23 110.758 -176.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -94.65 120.94 35.67 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 107.648 -1.242 . . . . 50.32 107.648 172.402 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 47.6 t -97.56 135.42 32.01 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 C-N-CA 123.812 0.845 . . . . 74.35 109.481 -173.123 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 54.8 tp60 -130.99 133.69 46.02 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.449 0.7 . . . . 73.11 109.312 -178.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.576 HG11 ' HD2' ' A' ' 12' ' ' LYS . 53.5 t -59.95 118.84 3.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 123.101 0.561 . . . . 75.13 110.463 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.489 ' H ' ' HA ' ' A' ' 44' ' ' LEU . 26.3 tpt180 -90.4 -49.47 6.5 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.514 0.726 . . . . 73.21 109.701 -173.253 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 18.8 ttt180 -160.86 151.39 18.13 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.845 0.858 . . . . 61.14 109.774 -178.55 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.401 HG21 ' HD3' ' A' ' 12' ' ' LYS . 64.1 t -114.97 128.43 72.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 123.62 0.768 . . . . 75.02 109.214 173.78 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -117.22 137.6 52.26 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 124.677 1.191 . . . . 72.11 107.897 176.459 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -107.54 119.99 40.95 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 107.364 -1.347 . . . . 64.42 107.364 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -130.7 75.66 1.67 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.714 0.806 . . . . 71.33 108.882 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 63.02 -114.48 6.94 Favored Glycine 0 C--N 1.348 1.21 0 CA-C-N 114.932 -1.031 . . . . 40.2 112.724 -178.724 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -82.89 -21.16 34.32 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.111 0.565 . . . . 54.52 110.906 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.429 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 24.7 m -100.62 104.22 15.54 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.704 0.801 . . . . 73.22 110.67 -178.628 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.68 HD13 ' HG3' ' A' ' 8' ' ' LYS . 77.9 mt -83.77 109.12 16.91 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 N-CA-C 108.806 -0.812 . . . . 73.14 108.806 172.598 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.571 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 64.2 mtt180 -88.84 95.46 10.3 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.133 0.973 . . . . 70.5 110.045 -179.328 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 57.0 t -87.92 110.71 21.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 N-CA-C 109.08 -0.711 . . . . 72.23 109.08 176.556 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -76.43 134.1 39.68 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 109.429 -0.582 . . . . 73.24 109.429 169.122 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.489 ' HA ' ' H ' ' A' ' 31' ' ' ARG . 4.3 mp -131.78 168.4 17.87 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.058 0.543 . . . . 53.33 109.803 174.822 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -110.17 130.15 55.59 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 107.615 -1.254 . . . . 72.43 107.615 -179.596 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.627 ' HB3' ' CE2' ' A' ' 55' ' ' TYR . 6.8 tt -139.74 135.66 33.35 Favored 'General case' 0 C--O 1.249 1.057 0 N-CA-C 106.472 -1.677 . . . . 52.02 106.472 -179.516 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 83.1 mtt180 . . . . . 0 CA--C 1.536 0.412 0 CA-C-N 115.448 -0.796 . . . . 74.02 110.557 -166.965 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.238 0.48 0 N-CA-C 109.814 -0.439 . . . . 75.43 109.814 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 14.5 mp0 -129.6 139.31 51.5 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.346 0.658 . . . . 53.31 109.722 170.596 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -92.56 122.55 35.09 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.913 0.885 . . . . 64.13 109.181 172.226 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.627 ' CE2' ' HB3' ' A' ' 46' ' ' LEU . 12.0 m-85 -107.23 116.7 32.4 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 108.472 -0.936 . . . . 74.14 108.472 179.067 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 29.8 m -88.77 99.33 12.28 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 107.589 -1.263 . . . . 73.21 107.589 177.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.561 HG13 HG12 ' A' ' 71' ' ' ILE . 47.0 t -91.84 103.64 14.75 Favored 'Isoleucine or valine' 0 C--O 1.239 0.545 0 N-CA-C 107.339 -1.356 . . . . 73.12 107.339 -178.201 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.571 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 43.1 mt-10 -85.44 101.66 12.8 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.136 -1.393 . . . . 70.22 108.759 -174.708 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.491 ' HB ' HG13 ' A' ' 11' ' ' VAL . 34.5 t -112.09 112.75 41.86 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 C-N-CA 123.985 0.914 . . . . 63.41 108.944 -175.026 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.624 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 42.1 tt0 -105.04 149.39 25.84 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.586 0.755 . . . . 72.31 111.164 -174.744 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -77.11 112.02 13.31 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.687 0.795 . . . . 62.12 109.188 173.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -121.21 111.69 17.71 Favored 'General case' 0 C--O 1.242 0.694 0 N-CA-C 107.891 -1.152 . . . . 73.52 107.891 171.364 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 75.09 -109.35 2.76 Favored Glycine 0 C--N 1.346 1.121 0 N-CA-C 110.778 -0.929 . . . . 55.11 110.778 -174.502 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -123.13 5.61 9.22 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.328 0.651 . . . . 62.22 109.822 176.371 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 67.9 p -110.54 148.0 33.02 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.382 0.673 . . . . 74.44 110.912 -176.16 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -96.17 112.02 23.89 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.185 0.994 . . . . 74.33 108.826 173.541 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.0 t -113.79 131.31 56.27 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 123.666 0.786 . . . . 72.42 110.211 -173.111 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.407 HG22 HG22 ' A' ' 59' ' ' VAL . 98.4 t -70.28 107.71 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 N-CA-C 109.247 -0.649 . . . . 53.51 109.247 174.264 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.624 ' HD3' ' HB3' ' A' ' 60' ' ' GLU . 30.6 mmmt -66.82 -52.83 39.19 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 115.23 -0.895 . . . . 73.44 109.498 176.288 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.5 ptt180 -162.71 164.9 26.2 Favored 'General case' 0 C--O 1.241 0.636 0 CA-C-N 114.508 -1.224 . . . . 51.43 109.779 -179.469 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.561 HG12 HG13 ' A' ' 57' ' ' VAL . 41.5 mt -121.93 107.69 20.44 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 C-N-CA 123.947 0.899 . . . . 35.15 108.606 175.527 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 36.4 m -93.22 103.82 16.05 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.6 0.76 . . . . 63.34 109.836 -176.327 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 36.9 ttt180 -79.43 133.89 36.55 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.012 0.525 . . . . 62.41 109.63 175.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 8.1 t . . . . . 0 CA--C 1.544 0.735 0 N-CA-C 109.45 -0.574 . . . . 74.23 109.45 170.333 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 . . . . . 0 CA--C 1.54 0.576 0 N-CA-C 110.376 -0.231 . . . . 73.13 110.376 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.539 ' O ' HG23 ' A' ' 11' ' ' VAL . 33.5 mm-40 -63.15 -49.76 73.05 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-O 118.988 -0.53 . . . . 74.11 110.02 177.333 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.46 -25.82 68.19 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 112.153 0.427 . . . . 75.12 112.153 178.646 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -63.65 -45.46 90.09 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.067 0.46 . . . . 75.34 109.832 172.406 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.401 ' O ' HG23 ' A' ' 14' ' ' VAL . 49.0 mt-30 -69.04 -37.73 78.74 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 115.229 -0.896 . . . . 72.23 110.843 177.984 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 7' ' ' GLU . 79.7 t -66.23 -50.68 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 123.806 0.842 . . . . 63.24 111.769 -174.351 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.512 ' HD3' HG21 ' A' ' 33' ' ' VAL . 34.3 mtmm -65.84 -32.86 74.62 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 123.236 0.335 . . . . 71.43 111.036 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -65.89 -53.52 38.51 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 123.728 0.642 . . . . 45.15 110.285 177.082 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.472 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 78.9 t -59.2 -37.72 70.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 C-N-CA 123.03 0.532 . . . . 75.43 110.351 178.446 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.36 -44.77 86.59 Favored 'General case' 0 C--O 1.246 0.901 0 C-N-CA 123.613 0.765 . . . . 73.51 111.899 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -71.38 -31.24 67.08 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 116.396 -0.365 . . . . 72.23 110.591 -178.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.493 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 47.1 mt-10 -65.79 -39.86 91.36 Favored 'General case' 0 C--N 1.355 0.816 0 O-C-N 123.899 0.749 . . . . 61.44 110.686 179.766 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.5 ' HB2' HD11 ' A' ' 71' ' ' ILE . 67.8 mmtt -73.21 -28.2 62.04 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-O 120.81 0.338 . . . . 72.23 110.69 178.718 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.571 ' HB3' HD12 ' A' ' 46' ' ' LEU . 53.3 mt -70.2 -31.09 68.37 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.971 0.509 . . . . 73.34 111.069 169.472 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.1 mt -79.68 -17.95 52.49 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.891 0.876 . . . . 65.13 110.946 175.402 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 8.7 mm-40 -71.63 -41.05 69.29 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 109.736 -0.468 . . . . 74.0 109.736 172.278 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -76.54 -37.25 56.94 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 115.276 -0.875 . . . . 64.41 110.554 178.293 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.3 t -153.69 86.42 3.9 Favored Pre-proline 0 CA--C 1.551 1.006 0 C-N-CA 123.693 0.797 . . . . 43.12 110.779 -173.097 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo -78.37 -19.22 11.91 Favored 'Trans proline' 0 C--N 1.374 1.92 0 C-N-CA 122.505 2.137 . . . . 40.02 112.629 177.568 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -77.44 -19.68 55.67 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.68 0.792 . . . . 73.31 111.05 -175.24 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 31.4 m -100.13 141.58 32.76 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.178 0.591 . . . . 73.12 110.047 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -77.4 119.85 21.58 Favored 'General case' 0 C--O 1.243 0.755 0 C-N-CA 124.03 0.932 . . . . 72.41 109.546 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.9 t -98.32 112.4 30.33 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 N-CA-C 109.429 -0.582 . . . . 55.34 109.429 -178.764 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.435 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 30.7 mm-40 -94.93 174.42 7.1 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.353 1.061 . . . . 64.33 109.367 172.882 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.457 HG11 ' HD2' ' A' ' 12' ' ' LYS . 47.1 t -106.38 137.21 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 N-CA-C 108.961 -0.755 . . . . 61.45 108.961 169.352 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -102.7 -54.2 2.7 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.936 0.495 . . . . 74.11 110.19 179.521 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -153.88 147.84 25.55 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.994 0.918 . . . . 72.22 109.103 -176.696 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.531 HG13 HG22 ' A' ' 42' ' ' VAL . 88.1 t -121.51 118.83 57.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 N-CA-C 108.347 -0.983 . . . . 64.15 108.347 176.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -116.66 109.87 17.75 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.146 0.578 . . . . 63.34 109.743 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.52 ' HG2' HG12 ' A' ' 40' ' ' ILE . 2.8 tmtp? -83.65 117.25 23.06 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 107.138 -1.43 . . . . 75.12 107.138 178.664 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.0 89.88 2.81 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 108.983 -0.747 . . . . 71.41 108.983 -178.338 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.407 ' O ' ' HE2' ' A' ' 35' ' ' LYS . . . 69.08 -111.46 3.94 Favored Glycine 0 C--N 1.344 1.023 0 O-C-N 123.612 0.57 . . . . 74.12 113.464 173.41 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -96.92 1.14 50.09 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.29 0.636 . . . . 73.42 111.388 177.521 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 23.7 m -131.24 107.88 9.3 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.327 0.651 . . . . 71.3 110.211 -176.143 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.535 HD12 HG21 ' A' ' 11' ' ' VAL . 33.7 mt -83.62 107.46 15.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 N-CA-C 108.497 -0.927 . . . . 71.45 108.497 172.089 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.527 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 98.1 mtt180 -86.36 95.27 9.6 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 109.008 -0.738 . . . . 75.11 109.008 176.097 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.531 HG22 HG13 ' A' ' 33' ' ' VAL . 58.5 t -86.73 113.48 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 N-CA-C 108.762 -0.829 . . . . 64.43 108.762 177.194 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -86.98 104.42 16.28 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 124.087 0.955 . . . . 64.31 108.518 174.523 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.435 ' HB3' ' O ' ' A' ' 29' ' ' GLN . 4.8 mp -97.24 165.93 11.81 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 109.754 -0.461 . . . . 52.5 109.754 179.393 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -116.64 104.85 11.8 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.119 0.485 . . . . 72.42 109.983 -179.575 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.571 HD12 ' HB3' ' A' ' 19' ' ' LEU . 6.8 tt -107.42 129.39 54.94 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 106.927 -1.508 . . . . 73.4 106.927 177.94 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 55.8 mtm180 . . . . . 0 N--CA 1.471 0.614 0 N-CA-C 108.48 -0.933 . . . . 61.41 108.48 -178.302 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt . . . . . 0 CA--C 1.536 0.44 0 N-CA-C 108.562 -0.903 . . . . 72.3 108.562 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -126.26 145.38 50.43 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.17 0.588 . . . . 75.13 110.17 -177.414 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -108.32 129.98 55.21 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.207 0.603 . . . . 52.54 109.421 177.263 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.467 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 42.0 m-85 -113.91 118.93 35.58 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 108.911 -0.774 . . . . 73.14 108.911 179.085 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 31.9 m -83.57 101.45 11.47 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 108.948 -0.76 . . . . 34.34 108.948 176.192 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.464 HG13 HG12 ' A' ' 71' ' ' ILE . 48.0 t -94.91 110.38 23.81 Favored 'Isoleucine or valine' 0 C--O 1.239 0.514 0 CA-C-N 115.24 -0.891 . . . . 72.5 109.274 179.362 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.527 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 37.3 mt-10 -78.66 106.35 10.58 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.961 0.904 . . . . 70.1 109.089 177.095 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.549 HG22 HG22 ' A' ' 68' ' ' VAL . 41.6 t -111.65 114.36 46.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 N-CA-C 108.657 -0.868 . . . . 73.42 108.657 178.009 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -102.26 155.88 17.93 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.279 1.032 . . . . 64.0 110.781 -171.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.448 ' NH2' ' HA ' ' A' ' 64' ' ' ASN . 14.6 tpt180 -89.35 133.09 34.65 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.637 0.775 . . . . 75.15 110.146 -177.216 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -141.22 91.85 2.43 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 108.729 -0.841 . . . . 74.41 108.729 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.94 -102.78 1.03 Allowed Glycine 0 C--N 1.345 1.031 0 CA-C-N 116.095 -0.502 . . . . 44.52 112.707 179.59 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.448 ' HA ' ' NH2' ' A' ' 61' ' ' ARG . 19.8 m-80 -115.15 1.94 13.99 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.158 0.983 . . . . 73.14 111.174 177.687 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 71.5 p -115.51 166.63 11.68 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.812 0.845 . . . . 72.44 110.769 -178.415 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -117.65 136.37 53.37 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.116 0.966 . . . . 73.45 108.77 174.21 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 6.2 t -126.01 122.38 35.72 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.004 0.921 . . . . 64.44 110.048 -175.25 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.549 HG22 HG22 ' A' ' 59' ' ' VAL . 86.2 t -73.59 115.83 15.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 122.593 0.357 . . . . 72.12 110.203 178.23 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -74.57 -57.07 4.16 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.028 0.931 . . . . 73.44 110.441 178.038 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -160.47 148.2 16.2 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 116.174 -0.466 . . . . 72.32 110.683 -178.612 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.5 HD11 ' HB2' ' A' ' 18' ' ' LYS . 47.0 mt -105.44 106.78 21.16 Favored 'Isoleucine or valine' 0 C--O 1.24 0.596 0 N-CA-C 108.608 -0.886 . . . . 63.51 108.608 168.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 66.7 m -109.57 115.59 30.18 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.683 0.793 . . . . 72.24 108.92 176.904 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.467 ' HA ' ' HA ' ' A' ' 55' ' ' TYR . 49.4 ttp180 -68.38 145.66 53.94 Favored 'General case' 0 C--O 1.243 0.722 0 N-CA-C 109.473 -0.566 . . . . 63.15 109.473 176.283 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 14.6 t . . . . . 0 C--O 1.242 0.69 0 O-C-N 123.863 0.727 . . . . 72.11 110.081 -179.464 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.5 mm-40 . . . . . 0 N--CA 1.478 0.969 0 N-CA-C 112.744 0.646 . . . . 74.02 112.744 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.575 ' O ' HG23 ' A' ' 11' ' ' VAL . 77.2 mt-10 -57.14 -56.89 15.95 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 124.085 0.866 . . . . 74.54 109.407 170.894 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -69.21 -32.21 71.32 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.257 0.623 . . . . 73.33 110.71 -176.427 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 29.8 mmt180 -55.45 -48.98 73.63 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.564 0.746 . . . . 62.2 110.122 174.509 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.547 ' O ' HG23 ' A' ' 14' ' ' VAL . 64.7 mt-30 -64.32 -45.38 88.15 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 114.26 -1.336 . . . . 70.31 111.16 178.172 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.619 HG21 HD12 ' A' ' 40' ' ' ILE . 59.0 t -61.53 -44.51 98.72 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 123.23 0.612 . . . . 73.33 111.899 -176.044 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt -65.19 -34.25 77.94 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.092 0.557 . . . . 71.01 110.24 178.27 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.48 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 58.1 tt0 -64.59 -51.7 61.33 Favored 'General case' 0 C--N 1.352 0.704 0 CA-C-N 115.656 -0.702 . . . . 72.5 110.418 175.192 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.547 HG23 ' O ' ' A' ' 10' ' ' GLN . 45.0 t -56.5 -46.75 82.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 C-N-CA 123.129 0.572 . . . . 74.12 109.578 -179.307 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.454 ' HB1' HD11 ' A' ' 44' ' ' LEU . . . -60.23 -47.5 85.72 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 114.896 -1.047 . . . . 62.41 112.29 -179.305 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -71.1 -35.4 71.8 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 122.822 0.449 . . . . 74.45 111.321 -175.575 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 36.4 mm-40 -69.09 -34.6 75.35 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.933 0.493 . . . . 75.51 111.021 -179.678 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.606 ' HB3' HD11 ' A' ' 71' ' ' ILE . 75.2 mmtt -68.16 -35.43 78.06 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.955 0.502 . . . . 70.31 111.063 176.102 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.551 ' HB3' HD12 ' A' ' 46' ' ' LEU . 29.8 mt -68.05 -31.84 71.78 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 115.518 -0.764 . . . . 74.33 111.291 174.657 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 84.9 mt -73.75 -26.11 60.5 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.927 0.891 . . . . 73.4 111.268 174.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 62.9 mm-40 -66.94 -40.68 87.63 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.652 0.381 . . . . 73.1 110.288 173.309 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -72.89 -40.92 65.19 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 123.892 0.745 . . . . 74.13 111.087 178.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.2 t -142.68 99.79 5.64 Favored Pre-proline 0 CA--C 1.548 0.867 0 CA-C-N 115.358 -0.837 . . . . 63.45 109.349 -175.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -79.61 -3.5 12.95 Favored 'Trans proline' 0 C--N 1.38 2.219 0 C-N-CA 122.598 2.198 . . . . 74.43 111.995 171.135 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -101.07 21.63 13.55 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.015 1.326 . . . . 74.55 110.269 -179.29 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 92.9 p -125.89 153.46 44.16 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 112.321 0.489 . . . . 51.42 112.321 -175.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -96.76 121.98 39.21 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 108.327 -0.99 . . . . 54.11 108.327 164.51 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 38.7 t -100.95 113.21 36.27 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 122.919 0.488 . . . . 73.12 109.739 177.269 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -96.74 159.4 14.95 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.225 1.01 . . . . 71.31 108.752 170.367 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.6 p -98.85 118.3 45.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 N-CA-C 108.413 -0.958 . . . . 72.04 108.413 170.805 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 21.8 tpt180 -85.78 -57.65 2.96 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 123.035 0.534 . . . . 72.12 110.429 -174.42 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.0 tpt180 -156.61 144.14 19.14 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.511 0.724 . . . . 75.31 109.753 -172.269 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 86.0 t -127.95 122.75 59.23 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 123.139 0.576 . . . . 72.32 110.282 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -106.8 129.53 54.65 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.641 1.176 . . . . 74.52 108.863 169.704 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.473 ' HG2' HG12 ' A' ' 40' ' ' ILE . 13.1 tmtt? -104.88 108.08 19.38 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 106.989 -1.486 . . . . 75.24 106.989 173.191 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -122.66 93.29 3.92 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.273 0.629 . . . . 73.41 110.173 -177.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 70.08 -98.13 0.62 Allowed Glycine 0 C--N 1.35 1.346 0 CA-C-N 115.497 -0.774 . . . . 73.22 112.343 178.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 47.5 m-80 -111.08 -29.25 7.96 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.052 0.541 . . . . 72.32 110.21 173.182 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 19.0 m -83.97 101.47 11.74 Favored 'General case' 0 C--N 1.352 0.69 0 CA-C-O 121.112 0.482 . . . . 63.33 110.204 -178.368 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.619 HD12 HG21 ' A' ' 11' ' ' VAL . 31.1 mt -87.95 112.69 23.95 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 CA-C-N 115.838 -0.619 . . . . 64.52 109.533 172.538 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.498 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 90.2 mtt180 -81.84 97.77 8.18 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 123.725 0.81 . . . . 73.14 109.645 174.346 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.431 HG12 ' HG ' ' A' ' 44' ' ' LEU . 61.2 t -91.3 107.42 18.69 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 N-CA-C 107.88 -1.156 . . . . 65.54 107.88 172.137 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -82.85 122.16 27.87 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 114.984 -1.007 . . . . 74.44 108.392 168.527 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.454 HD11 ' HB1' ' A' ' 15' ' ' ALA . 2.5 mp -116.41 153.64 31.7 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 109.358 -0.608 . . . . 74.15 109.358 -179.56 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.439 ' HG3' ' HD3' ' A' ' 52' ' ' LYS . 31.2 tt0 -111.42 103.89 12.29 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 109.301 -0.629 . . . . 74.12 109.301 175.594 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.551 HD12 ' HB3' ' A' ' 19' ' ' LEU . 7.3 tt -102.38 154.0 19.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.419 1.088 . . . . 74.34 109.444 -174.875 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 62.9 mtp180 . . . . . 0 N--CA 1.48 1.038 0 C-N-CA 123.439 0.696 . . . . 73.44 110.64 177.493 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.439 ' HD3' ' HG3' ' A' ' 45' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.415 0 N-CA-C 108.814 -0.81 . . . . 74.24 108.814 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -128.1 111.94 14.04 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.565 1.146 . . . . 64.4 109.061 178.359 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -78.78 133.68 37.07 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 109.067 -0.716 . . . . 75.52 109.067 173.511 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.421 ' HE2' HD22 ' A' ' 46' ' ' LEU . 75.9 m-85 -114.41 171.72 7.45 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.431 0.692 . . . . 75.13 109.887 172.965 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 86.2 m -143.88 102.64 3.93 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 106.7 -1.593 . . . . 73.31 106.7 175.236 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.441 HG22 HG12 ' A' ' 71' ' ' ILE . 46.9 t -98.84 105.06 16.8 Favored 'Isoleucine or valine' 0 C--O 1.243 0.723 0 N-CA-C 107.608 -1.256 . . . . 74.32 107.608 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.498 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 28.1 mt-10 -80.52 102.3 9.65 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 115.442 -0.799 . . . . 74.2 109.433 178.562 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.554 HG22 HG22 ' A' ' 68' ' ' VAL . 25.9 t -105.71 115.67 47.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 C-N-CA 124.109 0.963 . . . . 72.41 108.711 -178.697 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.598 ' HB3' ' HE2' ' A' ' 69' ' ' LYS . 35.6 tt0 -102.25 154.76 18.73 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.72 0.808 . . . . 64.51 110.023 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 29.5 ttp180 -80.29 139.64 36.55 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 120.958 0.408 . . . . 64.02 111.733 177.026 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -127.09 103.18 7.3 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.89 1.276 . . . . 75.41 107.642 172.308 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.31 -110.76 3.52 Favored Glycine 0 CA--C 1.53 1.007 0 N-CA-C 111.533 -0.627 . . . . 71.14 111.533 -173.475 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -101.34 -21.62 14.8 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.01 0.524 . . . . 71.14 110.869 170.824 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.8 p -86.22 174.73 8.91 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.193 0.597 . . . . 62.24 110.53 -172.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 89.3 m95 -124.98 147.38 48.95 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.625 0.77 . . . . 71.11 108.936 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.2 t -145.91 135.35 23.07 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.078 0.551 . . . . 73.3 110.224 -170.399 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.595 HG21 ' HG3' ' A' ' 18' ' ' LYS . 70.5 t -85.08 129.76 37.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 123.62 0.768 . . . . 75.13 110.593 -176.883 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.598 ' HE2' ' HB3' ' A' ' 60' ' ' GLU . 74.8 mmtt -81.5 -50.39 9.46 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.916 -0.583 . . . . 62.0 109.871 175.229 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 26.9 ptt-85 -168.83 167.63 10.92 Favored 'General case' 0 C--O 1.245 0.84 0 CA-C-N 115.35 -0.841 . . . . 64.5 110.111 -177.783 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.606 HD11 ' HB3' ' A' ' 18' ' ' LYS . 59.5 mt -117.81 109.09 26.26 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 115.089 -0.96 . . . . 74.33 108.851 173.568 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 34.2 m -102.56 124.3 47.86 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 109.677 -0.49 . . . . 44.15 109.677 178.602 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 46.7 ttp180 -82.82 146.85 28.7 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 108.718 -0.845 . . . . 74.32 108.718 171.226 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.3 t . . . . . 0 C--O 1.247 0.929 0 C-N-CA 123.034 0.534 . . . . 54.52 110.368 172.976 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.415 ' O ' ' HG2' ' A' ' 10' ' ' GLN . 2.6 mp0 . . . . . 0 C--O 1.242 0.685 0 N-CA-C 111.528 0.196 . . . . 74.41 111.528 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.523 ' O ' HG23 ' A' ' 11' ' ' VAL . 51.0 mt-10 -56.43 -55.38 34.28 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 109.018 -0.734 . . . . 75.22 109.018 171.076 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.474 ' HG3' HG11 ' A' ' 33' ' ' VAL . 0.6 OUTLIER -55.91 -40.96 73.83 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 124.918 1.386 . . . . 74.32 110.368 -175.27 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 84.1 mtt-85 -55.25 -46.0 76.05 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.233 1.013 . . . . 75.03 110.66 177.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.442 ' O ' HG23 ' A' ' 14' ' ' VAL . 68.3 mm-40 -72.29 -50.89 23.61 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.423 -0.808 . . . . 62.23 110.739 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 7' ' ' GLU . 43.0 t -64.32 -35.98 75.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 124.156 0.982 . . . . 65.44 112.026 -167.921 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 47.2 mtmt -63.1 -41.83 99.45 Favored 'General case' 0 N--CA 1.484 1.237 0 O-C-N 123.277 0.361 . . . . 42.54 110.09 176.116 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.456 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 9.5 tt0 -67.3 -43.94 80.46 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 124.249 0.968 . . . . 72.11 110.315 178.554 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.489 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 98.9 t -60.58 -43.43 94.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.369 0.668 . . . . 75.14 109.682 178.297 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.06 -41.61 73.92 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 114.782 -1.099 . . . . 41.1 112.078 -174.892 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.403 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 21.0 ptmt -67.13 -36.86 82.78 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 123.484 0.49 . . . . 73.02 110.114 -177.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.464 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 50.8 mt-10 -58.48 -46.01 87.52 Favored 'General case' 0 C--N 1.366 1.285 0 O-C-N 124.306 1.004 . . . . 74.42 109.788 177.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.489 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 31.9 mmmt -56.3 -43.76 79.24 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 124.671 1.232 . . . . 75.43 111.014 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 43.6 mt -72.08 -29.74 64.41 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 114.948 -1.023 . . . . 72.52 111.5 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 97.7 mt -76.03 -25.23 55.45 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.293 0.637 . . . . 73.24 111.108 176.526 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 17.4 mm-40 -67.42 -35.02 78.44 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-O 121.453 0.644 . . . . 74.31 109.911 175.276 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -88.77 -28.6 20.38 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 114.931 -1.031 . . . . 74.24 111.336 -179.152 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.514 ' HB3' HD11 ' A' ' 46' ' ' LEU . 32.4 t -150.93 84.92 5.26 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 123.248 0.619 . . . . 73.51 110.332 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -79.73 -6.41 14.33 Favored 'Trans proline' 0 C--N 1.376 2.019 0 C-N-CA 122.78 2.32 . . . . 75.43 112.946 176.21 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -90.11 7.49 37.62 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.655 0.782 . . . . 72.11 111.754 -178.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 39.9 t -133.25 158.52 42.7 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.375 0.67 . . . . 74.25 109.787 176.331 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -99.81 131.64 45.67 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.734 0.813 . . . . 63.05 108.948 177.854 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 40.9 t -98.46 129.92 48.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 C-N-CA 123.669 0.787 . . . . 73.11 109.679 -178.623 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -108.95 163.43 13.3 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.842 1.257 . . . . 71.45 109.526 177.197 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.8 p -90.99 119.06 37.45 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 N-CA-C 108.936 -0.765 . . . . 74.45 108.936 172.193 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 32.1 tpt180 -91.08 -58.37 2.49 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 109.195 -0.669 . . . . 55.54 109.195 178.785 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 -150.84 163.87 37.61 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.695 1.198 . . . . 65.22 109.578 173.518 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.53 HG13 HG22 ' A' ' 42' ' ' VAL . 47.0 t -131.96 115.85 28.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 N-CA-C 108.235 -1.024 . . . . 63.12 108.235 172.859 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 24.3 mp0 -101.23 124.98 47.77 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.363 0.665 . . . . 61.41 110.309 177.555 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.4 tptt -95.79 111.49 23.44 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.543 1.137 . . . . 73.2 109.341 175.325 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 20.1 mp0 -121.26 72.2 0.98 Allowed 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 108.892 -0.781 . . . . 75.53 108.892 175.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 59.33 -104.35 0.53 Allowed Glycine 0 C--N 1.344 0.996 0 CA-C-N 115.353 -0.84 . . . . 55.21 113.121 179.37 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -75.55 -41.56 54.62 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.082 0.553 . . . . 75.25 110.503 -179.24 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.466 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 29.0 m -95.57 117.94 31.36 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.214 0.605 . . . . 61.54 111.144 -175.217 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 38.2 mt -98.04 116.8 41.64 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 123.558 0.743 . . . . 54.41 109.235 169.185 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 61.5 mtt180 -103.37 99.66 9.5 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 108.594 -0.891 . . . . 62.33 108.594 178.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.53 HG22 HG13 ' A' ' 33' ' ' VAL . 39.5 t -85.52 125.87 40.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 109.098 -0.704 . . . . 70.14 109.098 179.767 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -85.93 122.03 29.4 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 107.953 -1.129 . . . . 72.31 107.953 166.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.433 ' O ' ' HA ' ' A' ' 54' ' ' ASN . 4.2 mp -117.53 169.06 9.84 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.073 0.549 . . . . 53.34 109.643 178.052 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -134.19 103.0 5.58 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.224 0.535 . . . . 64.23 109.612 -174.512 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.514 HD11 ' HB3' ' A' ' 23' ' ' SER . 8.7 tt -110.36 134.79 51.95 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 106.831 -1.544 . . . . 64.5 106.831 178.308 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 74.7 mtt85 . . . . . 0 N--CA 1.471 0.587 0 CA-C-O 121.463 0.649 . . . . 51.51 110.1 -175.595 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 79.4 tttt . . . . . 0 CA--C 1.543 0.698 0 N-CA-C 109.664 -0.495 . . . . 61.21 109.664 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -105.66 112.87 26.11 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.887 0.875 . . . . 73.35 109.457 175.811 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.433 ' HA ' ' O ' ' A' ' 44' ' ' LEU . 17.0 m120 -91.65 118.4 30.61 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.128 0.571 . . . . 72.13 110.239 176.68 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -108.14 120.69 43.07 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 109.043 -0.725 . . . . 71.52 109.043 177.817 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 57.0 m -88.31 102.41 14.82 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.841 -0.8 . . . . 74.5 108.841 173.143 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.403 HG13 HD13 ' A' ' 71' ' ' ILE . 96.7 t -93.22 106.09 17.56 Favored 'Isoleucine or valine' 0 C--O 1.24 0.564 0 N-CA-C 108.371 -0.974 . . . . 72.24 108.371 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -86.17 104.28 15.59 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 114.491 -1.232 . . . . 73.21 108.811 -176.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 17.5 t -113.84 128.88 70.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 124.138 0.975 . . . . 65.55 108.7 -178.197 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.466 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 38.2 tt0 -112.33 150.02 31.61 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.089 0.555 . . . . 62.41 110.476 -176.848 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.4 tpp85 -73.08 128.34 35.19 Favored 'General case' 0 C--N 1.35 0.59 0 C-N-CA 123.912 0.885 . . . . 72.24 110.649 -177.617 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -122.95 90.44 3.29 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 107.911 -1.144 . . . . 63.11 107.911 172.029 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 72.2 -103.32 1.29 Allowed Glycine 0 C--N 1.348 1.225 0 CA-C-N 116.127 -0.488 . . . . 54.25 112.603 -177.225 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -119.83 2.9 11.1 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 124.125 0.97 . . . . 74.43 110.247 173.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 18.7 p -113.5 176.59 4.96 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.519 0.728 . . . . 64.43 109.705 176.166 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -118.72 153.36 34.52 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.051 0.941 . . . . 74.01 111.323 -174.437 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 4.9 t -137.33 117.41 13.41 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.217 1.007 . . . . 64.35 108.741 175.331 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.7 t -69.41 108.46 1.88 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.508 0 N-CA-C 109.254 -0.647 . . . . 74.45 109.254 176.735 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -67.49 -57.53 6.36 Favored 'General case' 0 C--O 1.237 0.432 0 O-C-N 123.983 0.802 . . . . 63.14 110.27 177.621 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -151.36 141.03 21.76 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.117 -0.492 . . . . 74.2 111.329 -172.57 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.403 HD13 HG13 ' A' ' 57' ' ' VAL . 34.1 mm -93.46 105.43 16.82 Favored 'Isoleucine or valine' 0 C--N 1.352 0.692 0 N-CA-C 107.884 -1.154 . . . . 75.3 107.884 165.079 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 74.4 m -96.49 131.17 43.36 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 108.724 -0.843 . . . . 75.11 108.724 173.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -98.31 148.51 23.58 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 108.731 -0.84 . . . . 73.25 108.731 172.789 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.4 t . . . . . 0 CA--C 1.551 1.017 0 N-CA-C 109.153 -0.684 . . . . 51.45 109.153 170.12 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.47 ' HA ' ' HD3' ' A' ' 9' ' ' ARG . 37.1 tt0 . . . . . 0 N--CA 1.479 1.002 0 N-CA-C 111.759 0.281 . . . . 73.3 111.759 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.608 ' HG3' ' HD2' ' A' ' 8' ' ' LYS . 9.7 pt-20 -60.27 -33.95 73.04 Favored 'General case' 0 C--O 1.211 -0.958 0 CA-C-O 119.451 -0.309 . . . . 71.22 110.48 178.512 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.608 ' HD2' ' HG3' ' A' ' 7' ' ' GLU . 12.3 mptt -64.45 -43.86 92.96 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.16 0.584 . . . . 63.22 110.067 175.795 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.485 ' HA ' ' HE2' ' A' ' 12' ' ' LYS . 72.2 mtp180 -57.92 -43.26 86.12 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.117 0.967 . . . . 73.4 110.392 177.767 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.446 ' O ' HG23 ' A' ' 14' ' ' VAL . 52.5 mt-30 -64.71 -46.41 82.45 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 114.537 -1.211 . . . . 62.41 110.839 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.598 HG21 HD12 ' A' ' 40' ' ' ILE . 41.4 t -63.07 -39.7 86.21 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 124.793 1.237 . . . . 72.14 111.927 -177.148 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.485 ' HE2' ' HA ' ' A' ' 9' ' ' ARG . 49.8 mtmt -64.06 -37.5 87.67 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.54 0.736 . . . . 53.41 110.397 178.491 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -71.41 -43.67 66.35 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-N 115.552 -0.749 . . . . 75.34 110.554 179.285 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 10' ' ' GLN . 87.7 t -58.94 -42.3 85.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 124.036 0.934 . . . . 51.21 110.299 176.41 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.34 -48.93 68.66 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 114.825 -1.079 . . . . 42.21 111.777 -177.653 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.424 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 19.8 ptmt -67.09 -28.55 68.27 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 115.755 -0.657 . . . . 55.22 111.051 -175.776 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -60.56 -43.83 96.84 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.429 0.691 . . . . 75.32 111.478 176.031 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.502 ' HG3' HG21 ' A' ' 68' ' ' VAL . 59.3 mmtt -70.54 -26.7 63.69 Favored 'General case' 0 N--CA 1.481 1.108 0 O-C-N 123.708 0.63 . . . . 64.31 110.147 -178.579 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.705 ' HB3' HD12 ' A' ' 46' ' ' LEU . 21.8 mt -75.23 -32.06 61.04 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 115.107 -0.951 . . . . 64.51 111.22 173.481 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 95.4 mt -73.35 -21.79 60.45 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.425 0.69 . . . . 75.2 111.287 175.638 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -66.67 -36.18 81.92 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-O 121.544 0.687 . . . . 73.44 110.09 173.855 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -81.29 -41.51 22.02 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 114.82 -1.082 . . . . 72.41 111.069 -179.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.4 t -153.96 89.45 3.41 Favored Pre-proline 0 CA--C 1.554 1.114 0 C-N-CA 123.524 0.73 . . . . 73.32 109.364 -174.232 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.33 -26.73 10.13 Favored 'Trans proline' 0 C--N 1.375 1.943 0 C-N-CA 122.809 2.339 . . . . 73.53 113.067 177.026 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -68.9 -25.98 64.87 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.633 0.773 . . . . 70.52 111.298 -174.786 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 35.0 p -84.11 138.36 33.07 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.781 0.832 . . . . 63.5 110.845 177.636 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.507 ' HB3' ' NH2' ' A' ' 47' ' ' ARG . 2.7 tpmt? -82.31 111.78 18.69 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 108.432 -0.951 . . . . 64.41 108.432 175.165 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 41.0 t -97.45 120.05 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 124.062 0.945 . . . . 71.24 109.512 -173.205 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.431 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 84.5 mm-40 -107.27 172.18 6.97 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.261 1.024 . . . . 54.33 109.219 174.173 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.484 HG21 ' HB3' ' A' ' 12' ' ' LYS . 57.6 t -102.55 123.05 55.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 108.627 -0.879 . . . . 73.34 108.627 176.056 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.5 tpt180 -92.13 -48.13 6.88 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.152 0.581 . . . . 65.04 110.684 -174.811 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -149.26 145.04 26.88 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.572 1.149 . . . . 73.13 107.932 -173.699 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.441 HG22 HG13 ' A' ' 42' ' ' VAL . 86.3 t -125.17 130.6 73.03 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 N-CA-C 108.519 -0.919 . . . . 72.43 108.519 173.161 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -120.43 108.28 13.92 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.15 0.98 . . . . 63.33 109.415 178.327 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.6 tmtt? -97.16 111.97 23.97 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 108.312 -0.995 . . . . 74.13 108.312 -177.725 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -126.0 86.69 2.56 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.46 0.704 . . . . 72.33 109.48 -176.822 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 60.56 -80.77 0.01 OUTLIER Glycine 0 C--N 1.353 1.489 0 N-CA-C 115.223 0.849 . . . . 42.2 115.223 172.622 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -103.68 -45.81 4.7 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.181 0.993 . . . . 72.13 110.359 -177.908 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.543 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 8.9 m -100.33 133.69 44.37 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.231 0.613 . . . . 62.2 111.134 -175.687 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.598 HD12 HG21 ' A' ' 11' ' ' VAL . 32.7 mt -110.5 109.01 26.88 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.9 0 C-N-CA 123.481 0.712 . . . . 72.23 109.395 174.97 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 39.3 mtm180 -86.19 96.77 10.03 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 109.24 -0.652 . . . . 71.14 109.24 176.768 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.47 HG21 HG12 ' A' ' 11' ' ' VAL . 60.7 t -90.82 117.01 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 123.143 0.577 . . . . 73.24 109.47 176.964 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -91.73 115.28 27.92 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.462 1.105 . . . . 43.13 108.83 174.598 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.431 ' HB3' ' O ' ' A' ' 29' ' ' GLN . 4.1 mp -111.1 159.48 17.78 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 122.025 -0.422 . . . . 55.33 110.375 -176.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -106.48 107.19 18.07 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 109.184 -0.673 . . . . 72.32 109.184 178.225 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.705 HD12 ' HB3' ' A' ' 19' ' ' LEU . 7.1 tt -111.19 125.47 53.83 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 106.918 -1.512 . . . . 73.01 106.918 175.547 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.507 ' NH2' ' HB3' ' A' ' 27' ' ' LYS . 43.4 mtm180 . . . . . 0 N--CA 1.473 0.685 0 N-CA-C 109.282 -0.636 . . . . 61.41 109.282 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 76.4 tttt . . . . . 0 N--CA 1.48 1.047 0 CA-C-O 120.821 0.343 . . . . 73.14 110.448 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -134.53 122.31 22.23 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.911 1.284 . . . . 64.35 108.276 175.469 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -88.03 140.2 29.74 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 109.787 -0.449 . . . . 70.44 109.787 176.751 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -120.46 121.58 38.8 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.333 0.653 . . . . 73.32 109.562 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 24.6 m -86.97 103.72 15.61 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 108.17 -1.048 . . . . 73.1 108.17 175.786 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.448 HG13 HD13 ' A' ' 71' ' ' ILE . 58.7 t -102.3 114.81 42.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 124.218 1.007 . . . . 63.32 109.096 -179.181 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -89.02 101.98 14.63 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 109.063 -0.717 . . . . 73.0 109.063 179.37 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.59 ' HB ' HG13 ' A' ' 11' ' ' VAL . 22.2 t -105.11 109.99 29.48 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 C-N-CA 123.551 0.74 . . . . 64.33 109.273 178.055 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.543 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 34.8 tt0 -102.07 144.62 30.43 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.765 1.226 . . . . 73.24 111.039 -172.043 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 7.5 tpp180 -69.73 105.81 2.87 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.643 0.777 . . . . 71.4 109.574 176.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 52.2 tp60 -97.17 86.42 3.94 Favored 'General case' 0 C--O 1.242 0.707 0 N-CA-C 108.58 -0.896 . . . . 72.3 108.58 176.207 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 68.71 -101.02 0.73 Allowed Glycine 0 C--N 1.348 1.2 0 CA-C-N 115.18 -0.918 . . . . 54.13 111.168 -175.691 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -100.37 -33.05 10.54 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.67 1.188 . . . . 60.42 110.25 176.853 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 24.8 p -86.32 177.38 7.49 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.878 0.871 . . . . 64.52 110.814 -178.48 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -111.78 158.94 18.77 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.059 0.944 . . . . 73.41 109.038 172.248 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.5 t -145.99 137.65 24.98 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.675 0.79 . . . . 73.42 109.13 179.461 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.502 HG21 ' HG3' ' A' ' 18' ' ' LYS . 96.7 t -86.03 115.12 26.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 N-CA-C 108.94 -0.763 . . . . 64.31 108.94 176.924 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -74.89 -49.74 19.32 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 124.297 1.039 . . . . 61.33 110.25 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.1 ptp85 -157.89 159.92 37.1 Favored 'General case' 0 C--O 1.244 0.792 0 CA-C-N 115.228 -0.896 . . . . 73.03 111.277 177.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.448 HD13 HG13 ' A' ' 57' ' ' VAL . 36.4 mm -114.41 122.98 69.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 N-CA-C 106.508 -1.664 . . . . 73.33 106.508 167.281 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 11.7 t -126.98 133.93 50.48 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 109.116 -0.698 . . . . 75.2 109.116 171.82 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 22.1 ttm180 -91.92 140.33 29.78 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.382 -0.97 . . . . 74.13 108.382 176.276 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.3 t . . . . . 0 C--O 1.243 0.733 0 N-CA-C 108.533 -0.914 . . . . 64.41 108.533 171.777 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 . . . . . 0 N--CA 1.468 0.457 0 N-CA-C 111.428 0.158 . . . . 71.12 111.428 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.537 ' O ' HG23 ' A' ' 11' ' ' VAL . 6.4 mm-40 -58.03 -55.53 33.7 Favored 'General case' 0 C--N 1.347 0.475 0 O-C-N 123.634 0.584 . . . . 72.31 110.13 176.772 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -33.37 75.81 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 123.099 0.25 . . . . 62.23 111.309 179.775 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 20.5 mtp180 -65.16 -33.74 76.72 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 122.871 0.468 . . . . 74.42 110.786 178.403 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.423 ' O ' HG23 ' A' ' 14' ' ' VAL . 48.3 mt-30 -68.62 -49.63 57.74 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.362 0.665 . . . . 71.42 109.694 171.643 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.566 HG13 ' HB ' ' A' ' 59' ' ' VAL . 89.9 t -64.16 -46.3 93.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 123.543 0.737 . . . . 62.13 112.562 -171.057 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.475 ' HD3' HG21 ' A' ' 33' ' ' VAL . 50.5 mtmt -64.97 -36.04 83.13 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.364 0.666 . . . . 73.5 110.715 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.565 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 59.3 tt0 -66.43 -55.63 14.83 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.022 -0.99 . . . . 73.12 109.661 177.517 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.504 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 75.5 t -52.9 -43.16 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 123.439 0.695 . . . . 72.23 110.086 177.033 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.87 -45.06 91.05 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-N 115.065 -0.97 . . . . 75.34 111.787 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.414 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 19.6 ptmt -74.48 -28.47 61.03 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.259 -0.428 . . . . 60.12 110.873 -178.776 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 19.2 mm-40 -65.83 -35.78 81.63 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 123.43 0.456 . . . . 73.24 110.144 176.911 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.607 ' HG3' HG21 ' A' ' 68' ' ' VAL . 28.6 mmmt -73.37 -31.0 63.67 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 115.564 -0.744 . . . . 71.52 110.934 178.321 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.829 ' HB3' HD12 ' A' ' 46' ' ' LEU . 26.6 mt -74.42 -26.68 60.22 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.589 -0.732 . . . . 73.24 111.136 172.965 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 88.3 mt -77.85 -18.94 55.72 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.24 0.616 . . . . 55.22 110.576 172.788 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -69.79 -38.38 76.63 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.966 0.506 . . . . 74.2 110.515 170.288 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -76.38 -35.44 58.64 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 115.649 -0.705 . . . . 74.23 110.569 176.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 37.9 t -158.48 96.1 1.84 Allowed Pre-proline 0 CA--C 1.552 1.057 0 C-N-CA 123.259 0.624 . . . . 60.22 110.168 -176.554 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -77.96 -15.57 14.77 Favored 'Trans proline' 0 C--N 1.38 2.203 0 C-N-CA 123.057 2.505 . . . . 62.33 113.262 -177.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -88.84 -20.65 24.37 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.871 0.868 . . . . 63.44 111.422 -174.329 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 83.6 p -82.36 158.71 23.26 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.381 0.672 . . . . 74.12 112.744 -172.295 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -81.06 120.79 25.26 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.624 -0.717 . . . . 74.25 109.476 167.729 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 39.6 t -110.52 113.91 45.58 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 N-CA-C 108.254 -1.017 . . . . 74.21 108.254 172.508 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 56.1 tp60 -108.99 145.51 35.4 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.223 1.009 . . . . 73.35 108.743 177.112 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.2 p -71.26 127.78 33.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.951 0 N-CA-C 109.457 -0.572 . . . . 73.03 109.457 172.154 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.4 tpt180 -95.54 -62.11 1.35 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 122.657 0.383 . . . . 73.52 110.076 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -151.97 161.44 42.63 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.146 0.979 . . . . 71.4 109.733 -177.831 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.475 HG21 ' HD3' ' A' ' 12' ' ' LYS . 88.7 t -137.86 119.09 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 C-N-CA 123.911 0.885 . . . . 71.02 109.841 -176.906 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 21.1 mp0 -120.74 112.65 19.11 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.108 0.963 . . . . 71.13 109.611 -178.705 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.548 ' HG2' HG12 ' A' ' 40' ' ' ILE . 12.6 tmtt? -83.18 105.17 13.94 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 108.112 -1.069 . . . . 71.43 108.112 178.329 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -117.45 93.32 4.12 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.725 0.81 . . . . 71.51 110.167 -173.166 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 74.53 -95.68 0.89 Allowed Glycine 0 C--N 1.346 1.102 0 CA-C-N 116.193 -0.458 . . . . 54.53 112.432 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -118.68 -17.82 9.15 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.584 0.753 . . . . 64.02 109.583 172.804 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.466 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 11.9 m -93.38 106.03 18.04 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.192 0.997 . . . . 74.01 110.353 -177.348 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.554 HD12 HG21 ' A' ' 11' ' ' VAL . 52.7 mt -80.98 108.29 14.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 N-CA-C 108.968 -0.753 . . . . 64.43 108.968 170.852 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.546 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 80.8 mtt180 -80.82 100.69 8.94 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.21 -0.905 . . . . 75.13 109.076 174.92 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 35.9 t -92.38 111.12 23.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 108.356 -0.979 . . . . 62.44 108.356 173.305 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -77.84 126.02 30.22 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 108.801 -0.814 . . . . 75.12 108.801 167.139 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -129.78 156.32 44.52 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 108.941 -0.763 . . . . 65.34 108.941 174.994 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -116.95 106.86 13.88 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.444 1.098 . . . . 74.1 108.652 -174.697 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.829 HD12 ' HB3' ' A' ' 19' ' ' LEU . 6.9 tt -107.15 140.96 39.17 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 125.172 1.389 . . . . 72.35 108.532 -173.499 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.487 ' HA ' ' HA ' ' A' ' 52' ' ' LYS . 29.9 mtm180 . . . . . 0 N--CA 1.482 1.157 0 N-CA-C 109.49 -0.559 . . . . 72.31 109.49 178.71 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 47' ' ' ARG . 39.1 ttpt . . . . . 0 N--CA 1.472 0.626 0 N-CA-C 109.56 -0.533 . . . . 61.22 109.56 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -125.3 149.37 48.13 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 123.647 0.779 . . . . 52.55 110.86 -174.907 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -90.04 118.75 29.83 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.407 -0.815 . . . . 75.14 109.894 176.791 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -109.14 167.22 10.26 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.929 0.892 . . . . 65.35 109.506 173.839 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 42.7 m -144.62 105.08 4.11 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 108.538 -0.912 . . . . 75.22 108.538 177.342 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 42.4 t -92.71 104.98 16.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.621 0 N-CA-C 108.234 -1.024 . . . . 72.11 108.234 179.045 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.546 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 32.1 mt-10 -78.35 106.57 10.37 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 113.88 -1.509 . . . . 73.43 108.58 179.273 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.566 ' HB ' HG13 ' A' ' 11' ' ' VAL . 47.0 t -115.3 113.19 42.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 C-N-CA 123.684 0.794 . . . . 74.11 109.518 -176.896 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.534 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 32.2 tt0 -102.93 149.37 24.59 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.884 0.874 . . . . 62.13 110.483 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -67.97 129.98 41.58 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.112 0.565 . . . . 63.35 111.05 179.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 56.8 tp60 -119.05 79.86 1.46 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.88 0.872 . . . . 75.12 109.005 175.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 70.46 -100.75 0.83 Allowed Glycine 0 CA--C 1.531 1.065 0 CA-C-N 115.671 -0.695 . . . . 73.13 112.514 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -99.13 -28.0 13.56 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.844 0.857 . . . . 71.13 110.667 -179.794 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.9 t -100.82 172.13 7.25 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.522 0.729 . . . . 52.21 110.462 -178.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 94.3 m95 -107.52 151.52 25.47 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.485 0.714 . . . . 72.43 109.23 173.231 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 14.7 t -137.46 149.09 46.58 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.854 0.462 . . . . 64.43 110.631 -179.18 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.607 HG21 ' HG3' ' A' ' 18' ' ' LYS . 67.2 t -92.46 111.34 24.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 C-N-CA 123.671 0.788 . . . . 72.13 109.639 -175.661 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.534 ' HD3' ' HB3' ' A' ' 60' ' ' GLU . 30.7 mmmt -69.85 -57.84 4.59 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.751 0.82 . . . . 75.44 110.42 177.247 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.0 tpt180 -160.39 135.93 8.16 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.934 -0.575 . . . . 74.43 111.222 -178.0 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.58 HD11 ' HB3' ' A' ' 18' ' ' LYS . 56.8 mt -89.11 103.84 14.37 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 N-CA-C 107.388 -1.338 . . . . 74.32 107.388 164.226 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 86.0 m -99.89 114.68 28.07 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.488 0.715 . . . . 53.33 109.558 178.683 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 65.9 ttt180 -72.77 144.9 47.4 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 108.885 -0.783 . . . . 74.23 108.885 169.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 12.2 t . . . . . 0 N--CA 1.475 0.821 0 N-CA-C 108.782 -0.821 . . . . 63.43 108.782 171.566 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.9 ttm . . . . . 0 N--CA 1.475 0.813 0 CA-C-O 118.583 -0.722 . . . . 73.35 109.422 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -57.43 91.9 0.05 OUTLIER 'Trans proline' 0 C--N 1.381 2.272 0 C-N-CA 122.522 2.148 . . . . 74.41 110.903 172.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 48.3 m -72.21 122.19 20.63 Favored 'General case' 0 C--N 1.344 0.365 0 CA-C-N 114.9 -1.045 . . . . 74.15 109.317 -176.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.433 ' O ' ' HD2' ' A' ' 8' ' ' LYS . 28.8 tp10 -52.32 -39.5 60.68 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 124.561 1.163 . . . . 75.41 111.783 -176.595 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -59.7 -41.03 89.86 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 124.377 1.048 . . . . 72.54 110.167 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.567 ' HA ' ' HD3' ' A' ' 9' ' ' ARG . 34.0 tt0 -74.01 -26.65 60.55 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 114.907 -1.042 . . . . 75.24 110.816 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.46 ' O ' HG23 ' A' ' 11' ' ' VAL . 30.2 mm-40 -64.83 -38.2 90.19 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 119.316 -0.373 . . . . 55.21 110.819 178.598 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.433 ' HD2' ' O ' ' A' ' 4' ' ' GLU . 1.4 mptp? -59.78 -45.94 90.74 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 109.503 -0.555 . . . . 65.21 109.503 174.126 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.567 ' HD3' ' HA ' ' A' ' 6' ' ' GLU . 74.4 mtp180 -54.36 -42.12 69.94 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 124.144 0.902 . . . . 70.21 111.082 -178.787 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -70.84 -52.62 19.19 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.754 0.821 . . . . 74.04 111.306 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.68 HG21 HD12 ' A' ' 40' ' ' ILE . 96.3 t -64.79 -44.99 96.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 124.015 0.926 . . . . 74.12 112.15 -171.89 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.446 ' HD2' HG11 ' A' ' 30' ' ' VAL . 47.4 mtmt -68.28 -31.63 71.23 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 123.77 0.669 . . . . 64.52 110.704 -179.4 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.479 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 60.6 tt0 -69.51 -46.35 66.76 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 123.753 0.658 . . . . 71.24 110.033 176.122 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.487 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 68.8 t -58.67 -45.24 90.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 123.032 0.533 . . . . 61.1 109.631 175.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.508 ' HB1' HD11 ' A' ' 44' ' ' LEU . . . -60.61 -48.43 81.8 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.614 1.165 . . . . 71.02 111.741 -176.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.41 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 20.8 ptmt -67.74 -42.56 81.67 Favored 'General case' 0 C--N 1.351 0.639 0 O-C-N 123.63 0.581 . . . . 75.21 110.47 -178.393 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 63.3 mm-40 -63.64 -34.67 78.37 Favored 'General case' 0 C--N 1.357 0.932 0 O-C-N 123.62 0.575 . . . . 75.14 111.023 -177.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.495 ' HB3' HD11 ' A' ' 71' ' ' ILE . 65.9 mmtt -64.05 -40.93 97.38 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 123.654 0.596 . . . . 72.44 111.067 176.589 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.564 HD12 HG11 ' A' ' 28' ' ' VAL . 64.7 mt -70.41 -29.71 66.4 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 116.088 -0.506 . . . . 53.55 111.288 176.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 89.7 mt -77.65 -23.67 49.65 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.835 0.854 . . . . 63.32 110.556 175.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -74.04 -39.51 63.48 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.43 0.692 . . . . 75.35 109.543 172.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 95.6 mt-30 -73.38 -31.12 63.73 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 115.784 -0.643 . . . . 73.14 111.426 178.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.8 t -153.65 87.97 3.69 Favored Pre-proline 0 CA--C 1.56 1.362 0 C-N-CA 122.496 0.318 . . . . 52.11 110.307 -176.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -68.03 -17.13 45.96 Favored 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 123.658 2.905 . . . . 64.22 114.812 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -79.81 -17.46 53.29 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-O 121.03 0.443 . . . . 64.33 111.062 178.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 37.1 m -91.65 147.98 22.6 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.683 0.793 . . . . 73.41 111.443 -177.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -109.39 118.78 37.56 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 108.655 -0.868 . . . . 73.12 108.655 172.54 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.564 HG11 HD12 ' A' ' 19' ' ' LEU . 36.6 t -100.26 144.05 13.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 C-N-CA 124.02 0.928 . . . . 74.14 110.265 -175.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -132.58 147.96 52.36 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.342 1.057 . . . . 70.35 108.488 172.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.446 HG11 ' HD2' ' A' ' 12' ' ' LYS . 57.6 t -67.16 137.04 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.125 0.57 . . . . 74.33 109.975 177.01 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.8 tpt85 -115.7 -39.34 3.53 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.374 0.269 . . . . 73.41 110.965 -173.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.591 ' HB3' ' HB2' ' A' ' 43' ' ' GLU . 0.1 OUTLIER -167.8 144.46 4.17 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 108.551 -0.907 . . . . 54.3 108.551 -174.208 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.544 HG22 HG13 ' A' ' 42' ' ' VAL . 89.8 t -135.08 139.29 47.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 N-CA-C 108.838 -0.801 . . . . 65.22 108.838 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -135.35 113.69 11.47 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.902 0.881 . . . . 73.21 110.711 177.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.504 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 23.9 tptm -81.31 107.7 14.31 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 108.65 -0.871 . . . . 71.33 108.65 172.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -121.93 81.96 1.89 Allowed 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 108.681 -0.859 . . . . 71.24 108.681 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.504 ' O ' ' HE2' ' A' ' 35' ' ' LYS . . . 63.91 -125.65 32.98 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 111.521 -0.632 . . . . 44.12 111.521 -173.709 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -70.91 -30.47 66.81 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-N 117.524 0.662 . . . . 74.45 111.2 174.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 24.7 m -94.81 110.21 22.1 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 123.245 0.618 . . . . 73.43 111.798 -169.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.68 HD12 HG21 ' A' ' 11' ' ' VAL . 41.1 mt -95.57 113.5 30.1 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 123.799 0.84 . . . . 73.2 110.479 174.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 24.8 mtp-105 -87.88 101.56 13.85 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.286 0.634 . . . . 65.3 109.295 173.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.544 HG13 HG22 ' A' ' 33' ' ' VAL . 48.9 t -97.85 108.36 21.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 N-CA-C 108.763 -0.829 . . . . 73.41 108.763 176.319 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.591 ' HB2' ' HB3' ' A' ' 32' ' ' ARG . 51.9 mp0 -75.0 129.29 37.39 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 108.867 -0.79 . . . . 71.12 108.867 165.479 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.508 HD11 ' HB1' ' A' ' 15' ' ' ALA . 3.5 mp -122.72 168.29 12.4 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.878 -0.786 . . . . 72.14 108.878 172.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -126.41 108.63 11.39 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.297 -1.001 . . . . 74.4 108.297 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.416 HD12 ' HB3' ' A' ' 19' ' ' LEU . 6.8 tt -95.92 119.32 34.2 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.377 1.071 . . . . 75.41 108.112 -177.481 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 84.9 mtm180 -109.27 136.19 49.14 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.498 0.719 . . . . 74.23 109.914 -174.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.528 ' HB ' ' HB2' ' A' ' 51' ' ' LYS . 0.2 OUTLIER -144.71 176.88 9.11 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.634 1.174 . . . . 71.45 109.15 -176.09 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -62.63 98.42 0.12 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.847 0.859 . . . . 70.41 110.815 176.072 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 77.82 3.24 83.72 Favored Glycine 0 C--N 1.347 1.192 0 CA-C-N 115.746 -0.661 . . . . 71.43 113.868 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.528 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 44.2 mtpt -119.0 149.93 40.81 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.316 0.646 . . . . 52.22 110.317 177.414 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -150.47 99.68 2.79 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 107.223 -1.399 . . . . 75.42 107.223 167.104 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -104.48 114.82 29.31 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.222 0.609 . . . . 70.24 109.556 -174.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -75.39 117.98 17.78 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.645 -0.872 . . . . 65.14 108.645 171.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -105.92 170.46 7.89 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.646 0.778 . . . . 74.04 109.716 177.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 26.8 m -145.09 102.16 3.71 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 108.028 -1.101 . . . . 72.44 108.028 173.089 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.42 HG11 ' HA ' ' A' ' 15' ' ' ALA . 61.1 t -93.0 102.92 14.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 N-CA-C 107.019 -1.474 . . . . 71.13 107.019 178.362 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -89.19 105.3 17.7 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 114.298 -1.319 . . . . 70.42 108.14 -177.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 45.4 t -100.04 152.26 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 125.041 1.337 . . . . 73.54 109.52 -176.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -130.0 144.99 51.63 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.133 0.973 . . . . 70.3 110.207 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.8 tpt180 -81.33 113.04 19.16 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.774 0.83 . . . . 75.31 109.566 175.042 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 -120.42 100.63 7.27 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 107.998 -1.112 . . . . 72.25 107.998 170.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 72.49 -112.19 3.89 Favored Glycine 0 C--N 1.348 1.2 0 N-CA-C 111.368 -0.693 . . . . 45.25 111.368 -175.066 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -106.54 -16.13 14.61 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.571 0.748 . . . . 73.5 110.572 174.306 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 42.2 p -93.37 149.23 21.39 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 122.993 0.517 . . . . 75.35 111.166 -172.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -103.25 116.22 32.04 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.226 1.01 . . . . 75.05 109.905 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.1 t -108.49 145.22 35.04 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.762 0.825 . . . . 54.45 110.435 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.47 HG21 ' HG3' ' A' ' 18' ' ' LYS . 88.7 t -86.23 113.02 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 O-C-N 121.856 -0.527 . . . . 71.13 109.908 179.465 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.5 mmmp? -66.1 -47.47 74.09 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.913 0.885 . . . . 55.31 110.603 173.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -161.95 154.29 19.59 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.501 -0.772 . . . . 71.33 110.75 -178.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.495 HD11 ' HB3' ' A' ' 18' ' ' LYS . 80.3 mt -113.57 107.24 22.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 107.119 -1.438 . . . . 50.33 107.119 166.587 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 27.6 m -92.28 144.18 25.65 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.662 0.785 . . . . 72.32 109.063 178.112 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -116.18 148.48 40.32 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 107.21 -1.404 . . . . 74.51 107.21 170.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.1 t -59.6 135.4 57.66 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.452 0.701 . . . . 32.34 109.902 174.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 14.1 p -81.98 135.76 24.33 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 C-N-CA 123.219 0.608 . . . . 72.43 109.622 -177.291 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -102.62 150.14 17.9 Favored Glycine 0 C--N 1.344 0.985 0 C-N-CA 122.947 0.308 . . . . 54.41 112.492 -178.017 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 38.9 t -145.78 163.46 34.91 Favored 'General case' 0 C--O 1.248 1.026 0 C-N-CA 124.105 0.962 . . . . 73.04 109.003 175.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -66.4 134.45 52.54 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 108.977 -0.749 . . . . 71.33 108.977 172.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.26 -167.55 1.35 Allowed 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.79 0.836 . . . . 71.45 110.182 -173.417 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 79.0 t60 -121.49 117.64 27.34 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 107.598 -1.26 . . . . 73.51 107.598 168.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 52.8 m80 -61.96 121.62 13.44 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 109.423 -0.584 . . . . 71.22 109.423 177.199 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 17.5 t60 -71.75 -45.48 61.57 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.625 -0.88 . . . . 53.31 108.625 174.549 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 15.0 m-70 -87.07 127.34 35.12 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.072 -0.967 . . . . 72.15 109.071 175.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 60.1 m80 -121.75 137.9 54.58 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.297 1.039 . . . . 74.42 108.816 176.469 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 44.0 t-80 . . . . . 0 C--O 1.247 0.97 0 C-N-CA 123.741 0.816 . . . . 74.42 109.143 179.49 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 mmt . . . . . 0 N--CA 1.483 1.175 0 N-CA-C 110.116 -0.328 . . . . 75.32 110.116 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -72.43 111.9 3.33 Favored 'Trans proline' 0 C--N 1.374 1.904 0 C-N-CA 121.796 1.664 . . . . 72.12 111.087 174.298 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 64.6 m -113.66 149.64 34.37 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.585 0.754 . . . . 73.12 109.337 176.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -59.8 -30.54 68.98 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.56 0.744 . . . . 72.25 112.025 -175.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -75.7 -35.75 60.21 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.674 0.79 . . . . 72.45 110.645 177.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -70.52 -27.79 64.45 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.747 0.819 . . . . 73.41 110.662 173.573 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.552 ' O ' HG23 ' A' ' 11' ' ' VAL . 67.8 mm-40 -59.06 -47.31 85.69 Favored 'General case' 0 C--N 1.356 0.875 0 CA-C-O 118.745 -0.645 . . . . 72.12 110.696 -178.028 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.72 -35.46 72.71 Favored 'General case' 0 C--N 1.364 1.199 0 O-C-N 123.671 0.607 . . . . 43.11 111.022 177.279 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 20.9 mtm180 -65.55 -32.82 74.62 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 122.627 0.371 . . . . 73.42 110.902 178.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.409 ' O ' HG23 ' A' ' 14' ' ' VAL . 41.6 mt-30 -74.36 -38.48 63.19 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 122.99 0.516 . . . . 75.15 110.555 174.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.644 HG21 HD12 ' A' ' 40' ' ' ILE . 58.5 t -70.11 -44.29 78.28 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 C-N-CA 123.493 0.717 . . . . 62.03 111.288 -176.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.467 ' HD3' HG21 ' A' ' 33' ' ' VAL . 45.7 mtmt -63.03 -37.35 86.82 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.911 0.884 . . . . 62.11 110.02 177.733 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.452 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.3 tt0 -63.28 -55.65 22.98 Favored 'General case' 0 C--N 1.353 0.729 0 O-C-N 124.408 1.067 . . . . 71.14 110.072 177.672 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.527 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 95.8 t -55.84 -44.24 76.99 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 O-C-N 123.515 0.51 . . . . 61.12 109.941 178.468 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.435 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -60.24 -45.78 92.07 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 124.561 1.144 . . . . 62.24 112.156 -177.647 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -74.47 -31.98 62.42 Favored 'General case' 0 C--N 1.349 0.582 0 CA-C-N 116.02 -0.536 . . . . 62.45 110.68 -177.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 7.3 mm-40 -64.81 -38.39 90.82 Favored 'General case' 0 C--N 1.352 0.692 0 O-C-N 123.807 0.692 . . . . 75.31 110.014 176.086 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.527 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 29.0 mmmt -58.94 -49.89 76.14 Favored 'General case' 0 C--N 1.362 1.124 0 O-C-N 123.72 0.637 . . . . 72.52 110.617 176.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.645 ' HB3' HD12 ' A' ' 46' ' ' LEU . 53.1 mt -66.29 -29.26 69.44 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.227 -0.897 . . . . 63.45 112.194 -179.101 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.9 mt -78.86 -27.5 44.08 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.219 0.607 . . . . 54.34 111.078 176.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.445 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 52.7 mt-10 -70.94 -42.87 69.25 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 109.719 -0.474 . . . . 63.43 109.719 174.282 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -68.64 -41.85 78.83 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 115.168 -0.924 . . . . 74.23 111.001 178.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.2 t -145.58 91.51 5.72 Favored Pre-proline 0 CA--C 1.552 1.054 0 CA-C-N 115.662 -0.699 . . . . 72.12 109.453 -177.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -79.63 -2.85 12.52 Favored 'Trans proline' 0 C--N 1.378 2.102 0 C-N-CA 122.927 2.418 . . . . 55.24 112.15 174.435 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -95.26 13.93 23.96 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.399 1.08 . . . . 74.32 110.673 -178.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 60.1 p -135.21 148.87 49.77 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.048 0.539 . . . . 64.24 110.871 -175.555 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.402 ' HE2' ' HA ' ' A' ' 27' ' ' LYS . 11.1 mmpt? -90.3 114.63 26.73 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-O 121.256 0.551 . . . . 74.44 109.925 175.215 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 87.5 t -99.86 124.69 53.43 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 CA-C-N 114.29 -1.323 . . . . 72.23 109.252 -178.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -112.85 167.06 10.81 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.225 1.41 . . . . 63.24 108.157 174.454 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.41 HG21 ' HB3' ' A' ' 12' ' ' LYS . 87.6 t -104.96 110.92 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 N-CA-C 107.929 -1.137 . . . . 50.33 107.929 169.75 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -81.89 -43.82 17.65 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 122.767 0.427 . . . . 62.13 111.379 -171.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -162.78 146.21 11.14 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 108.168 -1.049 . . . . 70.23 108.168 -176.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.544 HG13 HG22 ' A' ' 42' ' ' VAL . 40.0 t -118.34 141.22 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 N-CA-C 108.892 -0.781 . . . . 53.14 108.892 177.175 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 21.3 tp60 -135.83 112.74 10.28 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 122.988 0.515 . . . . 73.02 110.241 177.245 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.413 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 3.2 tmtp? -86.11 117.48 24.97 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 108.349 -0.982 . . . . 74.23 108.349 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -129.23 75.89 1.68 Allowed 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.464 0.706 . . . . 70.4 110.083 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.413 ' O ' ' HE2' ' A' ' 35' ' ' LYS . . . 67.27 -96.99 0.35 Allowed Glycine 0 C--N 1.35 1.335 0 CA-C-N 115.274 -0.875 . . . . 74.31 113.971 173.525 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.705 ' HB3' ' HG3' ' A' ' 60' ' ' GLU . 16.7 m120 -80.24 -52.58 7.56 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 109.254 -0.647 . . . . 53.12 109.254 173.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 19.8 m -94.84 110.3 22.19 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 114.919 -1.037 . . . . 64.43 110.601 -168.293 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.644 HD12 HG21 ' A' ' 11' ' ' VAL . 41.9 mt -87.86 107.99 17.99 Favored 'Isoleucine or valine' 0 C--O 1.24 0.568 0 N-CA-C 108.541 -0.911 . . . . 71.52 108.541 169.563 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.56 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 86.8 mtt180 -82.97 96.54 8.35 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 109.0 -0.741 . . . . 61.1 109.0 174.717 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.544 HG22 HG13 ' A' ' 33' ' ' VAL . 40.7 t -88.29 114.11 26.31 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 107.832 -1.173 . . . . 74.05 107.832 174.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -85.94 107.16 17.6 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.907 0.883 . . . . 74.35 109.411 174.216 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.2 mp -99.43 170.51 8.57 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.689 0.796 . . . . 74.03 110.761 178.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -130.19 104.04 7.07 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.98 0.912 . . . . 62.45 109.37 -177.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.645 HD12 ' HB3' ' A' ' 19' ' ' LEU . 9.6 tt -104.58 143.96 32.35 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 108.432 -0.951 . . . . 74.52 108.432 -177.052 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 56.1 mtt85 -110.48 97.59 7.0 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 122.923 0.489 . . . . 61.23 110.814 -177.198 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 56.1 m -90.36 105.48 17.85 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.404 1.082 . . . . 64.54 109.472 179.059 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 65.78 27.31 11.16 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.2 1.0 . . . . 72.0 111.117 174.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 92.68 -12.95 68.66 Favored Glycine 0 C--N 1.35 1.343 0 CA-C-N 115.553 -0.749 . . . . 71.35 113.034 -177.103 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.422 ' HD2' ' N ' ' A' ' 51' ' ' LYS . 10.6 mptt -92.54 151.16 20.32 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.965 0.906 . . . . 73.22 109.487 178.7 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 33.9 ttpt -99.09 114.88 27.82 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.535 0.734 . . . . 75.21 111.734 -173.038 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -118.67 113.01 20.54 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 107.826 -1.176 . . . . 73.43 107.826 170.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -81.21 126.07 31.07 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.241 0.616 . . . . 73.41 110.031 177.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -113.06 118.73 35.6 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.198 0.599 . . . . 70.51 109.706 178.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 30.7 m -86.33 102.7 14.24 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.978 0.911 . . . . 63.13 109.093 174.349 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.465 HG13 HG12 ' A' ' 71' ' ' ILE . 56.0 t -91.54 105.91 17.06 Favored 'Isoleucine or valine' 0 C--O 1.243 0.733 0 N-CA-C 108.633 -0.877 . . . . 72.41 108.633 179.137 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.56 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 24.7 mt-10 -83.84 102.04 12.07 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 125.237 1.415 . . . . 52.32 108.985 -178.015 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.552 HG22 HG22 ' A' ' 68' ' ' VAL . 18.1 t -110.43 123.59 66.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 123.394 0.678 . . . . 70.11 109.373 -177.445 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.705 ' HG3' ' HB3' ' A' ' 38' ' ' ASN . 39.7 tt0 -102.97 142.97 33.17 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.123 0.969 . . . . 75.42 110.723 -175.753 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -79.96 111.72 16.57 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 123.584 0.754 . . . . 72.44 109.103 171.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 15.6 mm-40 -116.15 99.26 7.11 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 108.235 -1.024 . . . . 74.15 108.235 171.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.45 -106.07 1.69 Allowed Glycine 0 C--N 1.345 1.053 0 N-CA-C 111.115 -0.794 . . . . 62.44 111.115 -173.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -112.65 -17.57 12.56 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.014 0.926 . . . . 63.14 110.656 174.231 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 81.0 p -88.36 128.83 35.51 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 122.965 0.506 . . . . 74.45 110.279 -174.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.8 m95 -82.24 131.97 35.23 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.519 0.728 . . . . 73.51 109.287 172.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 8.8 t -132.67 121.12 22.66 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 123.442 0.697 . . . . 73.2 109.785 -175.635 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.552 HG22 HG22 ' A' ' 59' ' ' VAL . 97.7 t -74.32 104.02 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 123.605 0.762 . . . . 65.52 110.075 -179.244 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -70.0 -50.75 38.43 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.592 0.757 . . . . 74.52 110.754 -177.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 21.4 tpt180 -158.75 147.34 18.5 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.508 -0.769 . . . . 70.24 110.14 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.465 HG12 HG13 ' A' ' 57' ' ' VAL . 65.8 mt -110.55 105.73 19.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 N-CA-C 107.909 -1.145 . . . . 44.44 107.909 172.628 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 59.9 m -98.93 107.12 19.48 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.786 0.834 . . . . 60.02 110.302 -178.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 30.6 ttp180 -75.01 151.01 38.79 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.516 0.726 . . . . 72.33 110.439 175.061 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 15.1 t -77.71 151.47 34.16 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 123.399 0.68 . . . . 71.12 109.576 171.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 60.2 t -70.28 105.44 1.37 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.956 0 C-N-CA 123.192 0.597 . . . . 54.55 109.511 178.162 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 179.1 32.73 0.06 OUTLIER Glycine 0 C--N 1.351 1.37 0 O-C-N 123.381 0.426 . . . . 55.43 113.193 -178.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 24.7 m -75.61 140.26 42.52 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.408 0.683 . . . . 72.12 111.251 177.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.1 tt -78.93 102.78 8.46 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 108.38 -0.97 . . . . 73.45 108.38 174.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -67.8 120.28 13.88 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 109.04 -0.726 . . . . 63.44 109.04 174.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 31.4 m80 -81.22 92.16 6.29 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 123.306 0.642 . . . . 71.15 110.832 -169.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 35.0 m170 -73.99 120.54 19.71 Favored 'General case' 0 C--N 1.348 0.509 0 N-CA-C 108.643 -0.873 . . . . 72.51 108.643 173.248 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 16.1 p80 -115.5 119.19 35.37 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.4 0.68 . . . . 74.32 109.829 -175.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 11.3 t-80 -77.2 -31.37 55.23 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.394 1.078 . . . . 75.32 112.1 -175.364 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 12.1 p80 -95.47 178.08 5.61 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 122.309 0.243 . . . . 74.13 110.773 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 45.1 t-80 . . . . . 0 C--O 1.249 1.03 0 C-N-CA 123.146 0.578 . . . . 71.23 109.73 176.25 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.3 mmm . . . . . 0 N--CA 1.484 1.227 0 N-CA-C 109.56 -0.533 . . . . 73.33 109.56 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -55.61 92.78 0.04 OUTLIER 'Trans proline' 0 C--N 1.381 2.284 0 C-N-CA 122.433 2.089 . . . . 54.42 111.356 170.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 31.0 m -73.54 158.83 34.12 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-N 115.614 -0.721 . . . . 53.25 110.051 -179.092 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -64.47 -20.15 66.0 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 122.83 0.452 . . . . 52.33 111.747 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -89.86 -34.3 16.15 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 122.98 0.512 . . . . 74.41 111.15 172.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -66.95 -33.0 74.63 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.536 0.734 . . . . 64.5 111.442 -174.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.56 ' O ' HG23 ' A' ' 11' ' ' VAL . 12.2 pt-20 -59.39 -37.56 78.29 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 115.651 -0.704 . . . . 64.11 110.808 176.74 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.596 ' HG3' HG11 ' A' ' 33' ' ' VAL . 0.3 OUTLIER -54.84 -39.13 68.26 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 123.627 0.771 . . . . 73.55 111.142 177.925 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.8 mmm180 -62.39 -42.56 99.52 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.708 0.803 . . . . 75.33 109.93 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.447 ' O ' HG23 ' A' ' 14' ' ' VAL . 45.7 mm-40 -66.84 -43.08 84.62 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 114.729 -1.123 . . . . 74.33 110.937 177.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.601 HG21 HD12 ' A' ' 40' ' ' ILE . 63.7 t -67.89 -43.22 86.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 123.854 0.862 . . . . 72.14 111.655 -174.201 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -63.51 -31.91 73.21 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.029 0.531 . . . . 72.41 110.488 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.438 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 59.6 tt0 -66.71 -52.95 38.74 Favored 'General case' 0 C--N 1.349 0.554 0 O-C-N 123.847 0.717 . . . . 71.1 110.165 174.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 10' ' ' GLN . 66.1 t -59.71 -30.79 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 123.624 0.77 . . . . 64.03 110.804 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.511 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -76.17 -47.12 25.34 Favored 'General case' 0 C--O 1.248 0.992 0 C-N-CA 123.977 0.911 . . . . 62.24 111.992 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -70.59 -33.64 71.29 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 116.054 -0.521 . . . . 64.42 111.514 -172.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 23.1 mm-40 -65.92 -36.99 84.9 Favored 'General case' 0 C--N 1.353 0.753 0 O-C-N 123.789 0.68 . . . . 74.2 110.887 178.791 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.595 ' HG3' HG21 ' A' ' 68' ' ' VAL . 68.4 mmtt -60.66 -42.89 97.94 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 123.613 0.571 . . . . 62.25 111.303 176.502 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 51.4 mt -72.45 -30.23 64.4 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 115.756 -0.656 . . . . 70.13 111.859 178.355 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 68.8 mt -70.34 -27.38 64.31 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.204 0.602 . . . . 75.44 111.308 174.289 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 50.5 mt-10 -70.12 -35.05 73.83 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 120.947 0.403 . . . . 73.31 110.479 174.177 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -83.08 -24.98 32.45 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 115.61 -0.723 . . . . 72.03 111.664 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.0 t -158.56 93.61 1.95 Allowed Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 123.448 0.699 . . . . 45.54 109.394 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_endo -82.06 -9.45 11.76 Favored 'Trans proline' 0 C--N 1.373 1.828 0 C-N-CA 123.142 2.561 . . . . 74.11 113.683 -178.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -85.82 -6.18 59.14 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.263 0.625 . . . . 61.41 111.447 -178.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 64.6 p -114.37 140.54 48.57 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.198 0.999 . . . . 74.1 111.078 -175.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -80.15 127.61 32.52 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.903 -0.777 . . . . 55.5 108.903 171.091 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.558 HG22 HD12 ' A' ' 46' ' ' LEU . 39.6 t -98.71 112.67 31.4 Favored 'Isoleucine or valine' 0 C--O 1.239 0.532 0 O-C-N 123.535 0.522 . . . . 65.52 109.669 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -99.13 172.98 7.04 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.618 0.767 . . . . 71.42 109.394 175.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.7 p -98.3 132.87 42.47 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 N-CA-C 108.923 -0.769 . . . . 65.41 108.923 171.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.8 tpt180 -88.95 -47.44 8.14 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.399 0.68 . . . . 73.25 109.304 173.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.6 mtt180 -165.02 157.78 16.24 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.319 1.048 . . . . 64.13 109.755 175.536 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.596 HG11 ' HG3' ' A' ' 8' ' ' LYS . 73.0 t -116.49 110.27 30.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 N-CA-C 108.692 -0.855 . . . . 63.51 108.692 175.353 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -100.99 109.8 21.76 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.172 0.589 . . . . 75.13 109.435 -177.31 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.3 mmtt -79.69 136.29 36.75 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.915 0.886 . . . . 74.44 109.475 178.471 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -150.6 67.07 0.94 Allowed 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 107.928 -1.138 . . . . 73.13 107.928 -178.571 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 67.86 -135.24 30.28 Favored Glycine 0 C--N 1.349 1.277 0 CA-C-N 115.293 -0.867 . . . . 75.52 111.857 -173.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -76.45 -1.14 25.64 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.05 0.54 . . . . 33.32 111.856 176.073 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 55.1 m -99.84 141.66 32.36 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.462 0.705 . . . . 71.12 109.161 169.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.601 HD12 HG21 ' A' ' 11' ' ' VAL . 59.9 mt -129.79 117.4 41.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 C-N-CA 123.477 0.711 . . . . 53.32 109.222 171.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.424 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 9.8 mtp180 -81.91 97.9 8.28 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 108.684 -0.858 . . . . 74.22 108.684 169.031 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.6 t -80.71 114.19 21.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 N-CA-C 107.973 -1.121 . . . . 74.33 107.973 174.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -86.16 117.57 25.07 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 106.632 -1.618 . . . . 54.43 106.632 169.655 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.0 mp -111.92 169.84 8.56 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.054 0.454 . . . . 61.2 110.117 -179.073 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -141.58 107.64 5.19 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.696 0.76 . . . . 61.14 109.16 179.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.558 HD12 HG22 ' A' ' 28' ' ' VAL . 3.0 tt -113.21 135.52 53.73 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.522 1.529 . . . . 72.31 108.492 -173.131 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.425 ' HA ' ' O ' ' A' ' 51' ' ' LYS . 66.5 mtp180 -119.16 103.41 9.5 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-N 117.87 0.305 . . . . 72.21 111.463 -178.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 32.2 m -106.48 123.78 48.61 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.412 0.685 . . . . 73.51 109.982 177.164 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 62.92 20.22 12.09 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 124.218 1.007 . . . . 75.24 112.067 176.357 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.71 -21.45 45.88 Favored Glycine 0 C--N 1.35 1.317 0 CA-C-N 116.238 -0.437 . . . . 34.02 112.754 -176.367 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.425 ' O ' ' HA ' ' A' ' 47' ' ' ARG . 27.6 mmmt -70.68 124.14 23.56 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.395 0.678 . . . . 75.45 110.431 178.638 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -101.92 100.35 10.65 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 121.546 0.688 . . . . 71.52 109.655 -177.339 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -108.62 125.55 51.99 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 115.332 -0.849 . . . . 75.33 109.872 -175.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -78.72 146.06 34.14 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.199 0.523 . . . . 63.02 109.709 171.138 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -132.71 171.12 14.29 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.666 0.786 . . . . 74.1 109.507 177.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.682 ' HB ' ' HB ' ' A' ' 72' ' ' THR . 79.3 m -142.23 104.22 4.41 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 108.174 -1.047 . . . . 55.32 108.174 177.483 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.511 HG11 ' HA ' ' A' ' 15' ' ' ALA . 99.1 t -99.54 104.82 16.56 Favored 'Isoleucine or valine' 0 C--O 1.239 0.545 0 N-CA-C 107.726 -1.213 . . . . 72.14 107.726 174.281 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.424 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 31.5 mt-10 -82.59 100.21 10.01 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 114.007 -1.451 . . . . 61.52 108.618 -177.432 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.1 t -100.95 151.17 5.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 124.19 0.996 . . . . 74.42 109.132 -177.298 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -145.31 135.62 24.04 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 108.753 -0.832 . . . . 71.21 108.753 -175.054 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 31.1 ttp180 -80.29 133.27 35.95 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.152 0.581 . . . . 73.13 111.998 -172.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 64.3 mm-40 -121.08 109.24 14.8 Favored 'General case' 0 C--O 1.242 0.697 0 N-CA-C 107.515 -1.291 . . . . 73.04 107.515 175.571 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 67.88 -106.13 1.61 Allowed Glycine 0 C--N 1.345 1.029 0 N-CA-C 110.719 -0.953 . . . . 73.33 110.719 -171.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 54.3 t30 -110.41 -27.28 9.11 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.804 0.842 . . . . 50.44 110.022 172.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 33.9 p -77.75 172.52 13.29 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.163 0.585 . . . . 73.13 110.675 -177.117 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 89.0 m95 -125.76 146.68 49.67 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.376 0.67 . . . . 71.14 110.371 -175.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 6.1 t -137.75 144.07 41.48 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 122.892 0.477 . . . . 64.15 110.092 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.595 HG21 ' HG3' ' A' ' 18' ' ' LYS . 76.3 t -82.96 118.67 31.04 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 123.072 0.549 . . . . 61.21 109.86 177.494 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -88.62 -30.99 18.8 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 116.096 -0.502 . . . . 75.4 111.509 177.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 65.5 ttt-85 -158.66 137.17 10.94 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 120.527 0.204 . . . . 63.22 111.292 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 73.3 mt -103.02 131.18 51.88 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 N-CA-C 107.975 -1.121 . . . . 64.15 107.975 168.151 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.682 ' HB ' ' HB ' ' A' ' 56' ' ' THR . 27.8 m -128.1 150.2 50.07 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.203 1.001 . . . . 43.13 108.976 -177.455 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 27.4 ttp180 -126.41 145.37 50.49 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.079 0.952 . . . . 75.34 108.634 175.015 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.7 t -69.9 130.85 43.36 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-O 121.111 0.481 . . . . 54.21 110.053 177.088 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 2.5 p -101.23 103.65 15.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 N-CA-C 108.263 -1.014 . . . . 72.41 108.263 172.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -128.69 29.8 3.91 Favored Glycine 0 N--CA 1.472 1.047 0 CA-C-N 115.948 -0.569 . . . . 52.42 111.704 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 49.9 m -137.06 150.37 48.01 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.696 0.798 . . . . 74.3 109.719 -176.484 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 59.7 tp -73.62 104.31 4.52 Favored 'General case' 0 C--O 1.24 0.586 0 O-C-N 123.667 0.605 . . . . 54.31 109.624 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -77.87 137.29 38.3 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 123.829 0.852 . . . . 65.22 109.887 175.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -81.08 137.74 35.98 Favored 'General case' 0 C--O 1.241 0.622 0 N-CA-C 109.096 -0.705 . . . . 61.13 109.096 174.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 52.5 m80 -69.38 119.35 13.51 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 108.481 -0.933 . . . . 74.33 108.481 173.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 11.5 p80 -102.4 149.14 24.66 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 109.347 -0.612 . . . . 73.12 109.347 176.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 37.7 m80 -76.42 122.72 24.92 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 108.784 -0.821 . . . . 74.12 108.784 177.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -71.03 -29.09 64.92 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 109.654 -0.498 . . . . 71.31 109.654 174.254 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 . . . . . 0 C--O 1.249 1.067 0 CA-C-N 115.437 -0.801 . . . . 52.45 109.263 170.634 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.5 ttt . . . . . 0 N--CA 1.481 1.112 0 CA-C-O 118.934 -0.555 . . . . 73.21 110.005 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -64.09 91.82 0.17 Allowed 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.624 2.216 . . . . 74.13 112.259 175.03 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 39.4 t -152.89 160.45 43.06 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.223 1.009 . . . . 73.3 109.336 -179.026 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.86 -28.2 40.03 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 109.644 -0.502 . . . . 74.24 109.644 173.295 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -59.88 -34.66 73.45 Favored 'General case' 0 C--N 1.366 1.311 0 C-N-CA 123.973 0.909 . . . . 71.3 110.241 173.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -57.84 -41.6 82.67 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 124.583 1.177 . . . . 63.21 111.495 -177.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.554 ' O ' HG23 ' A' ' 11' ' ' VAL . 7.5 mm-40 -52.09 -52.41 51.46 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 124.295 0.997 . . . . 64.2 110.568 178.245 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.1 -43.2 96.1 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.17 -0.923 . . . . 74.32 109.811 -177.293 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 25.3 mtm180 -59.78 -35.12 73.99 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.6 0.76 . . . . 71.35 111.708 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.468 ' O ' HG23 ' A' ' 14' ' ' VAL . 58.5 mt-30 -75.12 -55.1 6.07 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.406 0.682 . . . . 72.21 110.511 179.085 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.586 HG13 ' HB ' ' A' ' 59' ' ' VAL . 42.8 t -62.73 -46.01 97.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 123.726 0.81 . . . . 74.23 111.766 -170.792 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -66.42 -33.4 75.63 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.135 0.574 . . . . 24.51 110.882 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -70.76 -44.34 66.94 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 123.603 0.564 . . . . 64.13 110.214 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.488 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 88.9 t -58.05 -50.35 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 N-CA-C 109.051 -0.722 . . . . 74.41 109.051 175.202 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.494 ' HB1' HD11 ' A' ' 44' ' ' LEU . . . -58.53 -45.91 87.89 Favored 'General case' 0 C--O 1.244 0.786 0 CA-C-N 114.368 -1.287 . . . . 72.41 112.292 -175.099 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.416 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 22.4 ptmt -69.45 -37.02 77.17 Favored 'General case' 0 C--N 1.353 0.749 0 O-C-N 123.525 0.515 . . . . 74.05 110.46 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.41 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 40.0 mt-10 -64.38 -34.03 77.23 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.319 0.647 . . . . 72.51 111.067 179.424 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.502 ' HG3' HG21 ' A' ' 68' ' ' VAL . 30.5 mmmt -69.87 -35.49 74.72 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.06 0.457 . . . . 64.54 110.504 178.088 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.759 ' HB3' HD12 ' A' ' 46' ' ' LEU . 41.7 mt -72.61 -23.57 60.96 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 115.257 -0.883 . . . . 74.31 111.299 173.302 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 96.4 mt -85.18 -17.66 36.47 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.986 0.914 . . . . 75.44 111.462 175.235 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 15.1 mm-40 -71.91 -44.13 64.2 Favored 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 108.467 -0.938 . . . . 72.25 108.467 169.063 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -78.52 -32.76 48.21 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 114.732 -1.122 . . . . 64.02 111.322 -177.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.547 ' HB2' HD11 ' A' ' 46' ' ' LEU . 49.0 m -154.83 80.9 4.38 Favored Pre-proline 0 CA--C 1.562 1.408 0 C-N-CA 123.854 0.861 . . . . 61.45 110.368 -173.584 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.2 -27.07 17.09 Favored 'Trans proline' 0 C--N 1.375 1.957 0 C-N-CA 122.722 2.282 . . . . 72.21 113.308 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -83.84 -9.67 58.59 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.343 0.657 . . . . 73.53 111.488 -177.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 38.0 m -89.34 145.98 25.0 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.274 0.63 . . . . 64.33 111.188 -177.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.424 ' HE2' ' HA ' ' A' ' 27' ' ' LYS . 0.6 OUTLIER -89.29 109.18 20.1 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.6 0.76 . . . . 71.43 109.641 -178.855 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 64.5 t -97.61 122.0 48.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 C-N-CA 124.05 0.94 . . . . 63.42 109.249 -175.339 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -101.37 148.44 25.15 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.492 1.117 . . . . 73.22 108.686 177.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 59.0 t -78.58 106.98 10.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 N-CA-C 107.68 -1.23 . . . . 64.35 107.68 166.38 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.7 tpt180 -82.12 -61.68 1.84 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 122.609 0.364 . . . . 73.02 110.021 -177.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -147.47 170.05 18.22 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 125.177 1.391 . . . . 62.31 109.359 179.064 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.412 HG13 HG22 ' A' ' 42' ' ' VAL . 61.4 t -135.57 114.85 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 N-CA-C 108.134 -1.062 . . . . 70.22 108.134 173.218 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -107.88 110.81 22.67 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.534 0.734 . . . . 70.31 109.219 -179.203 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.464 ' HG2' HG12 ' A' ' 40' ' ' ILE . 2.5 tmtp? -92.43 108.74 20.19 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 108.602 -0.888 . . . . 71.14 108.602 -176.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 18.9 mm100 -121.31 83.26 2.05 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.492 0.717 . . . . 72.53 110.026 -178.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.77 -108.96 2.66 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 115.206 -0.907 . . . . 72.23 112.889 178.118 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -93.34 -27.51 16.73 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.334 0.653 . . . . 70.5 110.2 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 32.6 m -93.11 97.72 10.85 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 123.6 0.76 . . . . 65.52 110.489 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.464 HG12 ' HG2' ' A' ' 35' ' ' LYS . 36.0 mt -86.19 107.45 16.58 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 N-CA-C 108.549 -0.908 . . . . 73.54 108.549 173.105 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 52.0 mtt85 -89.0 96.66 10.82 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.395 1.078 . . . . 70.24 109.797 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.423 HG23 HG12 ' A' ' 11' ' ' VAL . 57.3 t -80.82 124.45 38.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 108.575 -0.898 . . . . 72.03 108.575 175.357 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -90.94 124.09 34.94 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 107.966 -1.124 . . . . 72.15 107.966 174.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.494 HD11 ' HB1' ' A' ' 15' ' ' ALA . 2.0 mp -128.43 150.01 50.31 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 109.156 -0.683 . . . . 74.22 109.156 -179.326 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -108.81 106.04 15.88 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.376 0.608 . . . . 60.44 109.567 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.759 HD12 ' HB3' ' A' ' 19' ' ' LEU . 9.3 tt -92.68 109.11 20.53 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 107.527 -1.286 . . . . 75.31 107.527 -177.032 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -101.86 124.27 47.21 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.371 1.068 . . . . 71.34 109.59 -175.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.4 ' HB ' ' HB2' ' A' ' 51' ' ' LYS . 4.1 m -126.04 168.99 13.21 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 107.924 -1.139 . . . . 54.41 107.924 176.48 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -62.85 101.34 0.26 Allowed 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 118.184 0.447 . . . . 52.12 110.755 177.369 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 95.71 -8.82 68.6 Favored Glycine 0 C--N 1.345 1.045 0 CA-C-N 115.662 -0.699 . . . . 64.52 113.397 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.4 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 43.2 mtmt -114.8 142.0 47.13 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 117.529 0.664 . . . . 54.2 110.8 177.598 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -136.39 97.99 3.72 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 106.32 -1.733 . . . . 70.45 106.32 168.081 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -114.19 141.46 47.5 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.66 0.784 . . . . 54.24 109.641 -171.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -111.96 117.0 31.51 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 108.877 -0.786 . . . . 54.15 108.877 174.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -108.1 120.6 42.8 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.65 1.18 . . . . 75.03 110.095 178.1 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 32.9 m -88.94 101.44 14.07 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 108.775 -0.824 . . . . 73.15 108.775 168.275 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.545 HG22 HG23 ' A' ' 71' ' ' ILE . 43.0 t -91.88 106.62 17.91 Favored 'Isoleucine or valine' 0 C--O 1.243 0.746 0 N-CA-C 108.554 -0.906 . . . . 54.02 108.554 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -77.38 102.91 7.02 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 114.258 -1.337 . . . . 70.23 108.831 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.586 ' HB ' HG13 ' A' ' 11' ' ' VAL . 27.0 t -111.37 130.31 65.11 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 C-N-CA 123.809 0.844 . . . . 65.31 108.893 -178.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -120.2 141.15 50.17 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.252 0.621 . . . . 74.03 110.758 -173.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -74.59 116.33 15.16 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.487 0.715 . . . . 73.31 110.492 176.655 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 36.1 mm-40 -117.21 107.28 14.25 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.223 1.009 . . . . 64.03 108.623 171.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 63.18 -115.24 7.75 Favored Glycine 0 C--N 1.348 1.227 0 N-CA-C 111.124 -0.79 . . . . 52.3 111.124 -172.329 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -91.68 -32.21 15.53 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.504 0.721 . . . . 71.32 109.934 171.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 82.0 p -82.64 173.02 12.31 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.534 0.733 . . . . 61.41 112.129 -168.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -128.66 110.92 12.64 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.141 0.976 . . . . 75.12 110.365 -174.23 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.3 t -93.39 160.65 14.72 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.332 0.653 . . . . 44.31 110.672 177.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.502 HG21 ' HG3' ' A' ' 18' ' ' LYS . 48.1 t -100.42 120.86 50.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 123.203 0.601 . . . . 54.23 109.447 174.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -83.47 -53.07 5.97 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 123.938 0.895 . . . . 75.01 110.618 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 21.5 tpp180 -165.27 144.16 6.47 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.161 0.584 . . . . 63.53 110.422 177.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.545 HG23 HG22 ' A' ' 57' ' ' VAL . 59.2 mt -103.73 105.94 19.31 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 N-CA-C 107.934 -1.136 . . . . 74.44 107.934 172.032 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 57.4 m -97.98 103.89 15.87 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.621 0.769 . . . . 72.53 109.216 -178.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 36.3 ttp180 -85.93 147.4 26.26 Favored 'General case' 0 C--O 1.243 0.724 0 N-CA-C 109.501 -0.555 . . . . 75.32 109.501 175.253 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 10.0 t -61.89 136.77 58.11 Favored 'General case' 0 CA--C 1.554 1.118 0 O-C-N 123.771 0.669 . . . . 72.44 110.151 171.272 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 47.4 t -77.03 101.8 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 N-CA-C 108.834 -0.802 . . . . 51.02 108.834 -179.165 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -69.93 -52.22 20.32 Favored Glycine 0 C--N 1.351 1.382 0 CA-C-N 116.248 -0.433 . . . . 72.02 112.319 -179.131 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 28.0 m -117.02 111.35 19.43 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 124.302 1.041 . . . . 74.31 108.707 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 53.1 tp -77.62 103.49 7.59 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 109.565 -0.532 . . . . 60.21 109.565 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -77.15 87.37 3.62 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.492 -0.777 . . . . 74.24 109.264 176.095 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 55.2 t60 -139.08 142.17 38.15 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.535 0.734 . . . . 73.45 109.503 -176.307 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 -76.47 141.87 41.17 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.95 0.9 . . . . 74.23 110.581 -176.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 75.6 m-70 -86.88 146.21 26.28 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.158 0.583 . . . . 70.55 110.547 -179.209 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 10.9 p-80 -76.21 159.18 30.9 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.283 0.633 . . . . 74.12 110.676 176.449 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 47.2 m80 -84.32 -67.32 0.8 Allowed 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 108.632 -0.877 . . . . 65.01 108.632 172.344 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 . . . . . 0 C--O 1.254 1.333 0 N-CA-C 108.033 -1.099 . . . . 70.23 108.033 177.643 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 mpp? . . . . . 0 N--CA 1.482 1.169 0 N-CA-C 109.813 -0.439 . . . . 65.03 109.813 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -60.72 112.66 1.41 Allowed 'Trans proline' 0 C--N 1.377 2.077 0 C-N-CA 122.593 2.195 . . . . 73.14 111.732 170.139 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 46.5 p -89.66 31.5 0.93 Allowed 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.574 0.75 . . . . 53.23 111.483 -178.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -72.22 -46.08 57.64 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.002 0.921 . . . . 63.33 109.502 -173.271 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -69.66 -33.81 73.11 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.772 0.829 . . . . 75.41 110.882 176.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -57.51 -36.23 71.28 Favored 'General case' 0 C--N 1.358 0.955 0 C-N-CA 123.865 0.866 . . . . 74.43 111.672 -176.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.481 ' O ' HG23 ' A' ' 11' ' ' VAL . 44.7 mt-10 -52.4 -52.57 53.09 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 124.322 1.014 . . . . 72.41 110.448 175.609 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.451 ' O ' ' HG3' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -62.38 -42.42 99.4 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 124.545 1.153 . . . . 70.11 109.529 -175.731 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -59.58 -42.66 93.01 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.145 0.978 . . . . 75.42 110.567 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.417 ' O ' HG23 ' A' ' 14' ' ' VAL . 61.7 mt-30 -66.44 -49.79 65.53 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.218 1.007 . . . . 63.32 110.874 177.431 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.51 HG21 HD12 ' A' ' 40' ' ' ILE . 86.4 t -67.52 -35.27 72.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 124.012 0.925 . . . . 75.12 112.111 -170.64 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' A' ' 8' ' ' LYS . 53.4 mtmt -60.75 -36.36 78.72 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 122.704 0.402 . . . . 72.41 110.513 176.36 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.449 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 9.8 tt0 -71.39 -49.55 40.95 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 115.421 -0.809 . . . . 71.23 110.07 176.087 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.524 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 67.7 t -55.43 -40.25 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 123.396 0.678 . . . . 61.14 110.487 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.73 -47.64 58.67 Favored 'General case' 0 C--O 1.245 0.865 0 C-N-CA 124.603 1.161 . . . . 74.34 111.745 -176.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.401 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 22.4 ptmt -66.83 -33.92 76.67 Favored 'General case' 0 C--N 1.358 0.952 0 CA-C-N 116.134 -0.485 . . . . 72.4 110.714 -176.057 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.449 ' HG3' ' O ' ' A' ' 13' ' ' GLN . 53.0 mt-10 -61.18 -41.33 96.61 Favored 'General case' 0 C--N 1.36 1.047 0 O-C-N 124.064 0.852 . . . . 71.22 110.599 179.201 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.658 ' HG3' HG21 ' A' ' 68' ' ' VAL . 71.8 mmtt -68.25 -35.2 77.54 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 123.802 0.689 . . . . 61.44 110.825 -178.337 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 77.6 mt -70.08 -30.04 67.18 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.107 0.563 . . . . 73.34 111.535 173.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 95.1 mt -81.38 -16.77 51.24 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.667 0.787 . . . . 63.51 110.737 175.345 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -81.2 -46.1 15.36 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 109.427 -0.582 . . . . 73.3 109.427 172.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -71.85 -24.34 61.67 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.291 0.636 . . . . 73.54 111.319 178.231 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 t -158.01 82.83 2.83 Favored Pre-proline 0 CA--C 1.558 1.273 0 O-C-N 123.421 0.45 . . . . 64.24 110.138 -178.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -61.37 -33.57 88.63 Favored 'Trans proline' 0 C--N 1.381 2.282 0 C-N-CA 123.411 2.741 . . . . 73.52 115.01 -177.494 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -76.14 -18.45 59.12 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 122.815 0.446 . . . . 65.24 112.103 -175.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 58.3 m -76.64 148.68 36.75 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.381 0.672 . . . . 74.11 111.797 -177.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.512 ' HE3' ' HA ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -103.34 116.33 32.24 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.913 0.885 . . . . 72.34 109.77 174.107 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 51.1 t -99.36 141.24 17.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 CA-C-N 114.705 -1.134 . . . . 75.11 109.525 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -131.63 110.78 11.17 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 108.005 -1.109 . . . . 75.12 108.005 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.451 HG21 ' HB3' ' A' ' 12' ' ' LYS . 73.9 t -58.73 114.57 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 N-CA-C 109.434 -0.58 . . . . 73.14 109.434 178.106 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -92.29 -46.64 7.61 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 123.882 0.739 . . . . 74.1 110.756 -171.251 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 21.0 tpt180 -157.24 155.33 30.63 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.455 0.702 . . . . 72.23 109.951 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 89.9 t -126.42 141.46 45.83 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 124.33 1.052 . . . . 65.23 109.43 176.183 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 74.2 mm-40 -128.01 109.17 11.3 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 124.353 1.061 . . . . 65.04 108.931 177.447 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -92.12 110.72 22.1 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 108.084 -1.08 . . . . 71.12 108.084 178.079 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -122.9 90.28 3.26 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.314 0.646 . . . . 73.1 110.104 -179.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.56 -81.95 0.95 Allowed Glycine 0 C--N 1.35 1.352 0 CA-C-N 116.246 -0.433 . . . . 70.42 112.485 177.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -142.86 1.07 1.27 Allowed 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.695 1.198 . . . . 73.13 110.61 169.214 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 23.5 m -98.13 97.76 9.15 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.755 -0.831 . . . . 64.21 108.755 174.306 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.51 HD12 HG21 ' A' ' 11' ' ' VAL . 32.5 mt -92.49 107.66 19.27 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 C-N-CA 123.371 0.669 . . . . 52.31 110.067 178.735 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.519 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 94.3 mtt180 -87.41 105.26 17.15 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.389 1.076 . . . . 71.14 109.304 174.592 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 50.1 t -96.98 119.51 45.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 N-CA-C 109.086 -0.709 . . . . 72.41 109.086 175.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -83.16 116.58 22.42 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 108.62 -0.882 . . . . 54.13 108.62 170.126 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.4 mp -116.23 153.64 31.51 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 109.088 -0.708 . . . . 72.04 109.088 176.154 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -115.76 104.23 11.46 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 124.191 0.996 . . . . 74.02 108.474 -171.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.0 tt -98.95 111.15 23.63 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 108.36 -0.978 . . . . 75.22 108.36 -173.203 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 57.4 mtt85 -101.3 125.98 48.0 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.664 0.786 . . . . 74.31 110.152 -176.254 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 90.1 m -148.51 127.34 12.62 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.907 1.283 . . . . 62.03 109.295 -179.241 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 63.9 21.72 12.74 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 124.828 1.251 . . . . 73.12 112.444 175.131 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 92.35 -20.34 44.44 Favored Glycine 0 C--N 1.347 1.17 0 CA-C-O 120.13 -0.261 . . . . 53.41 112.466 -176.107 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -76.48 166.02 23.99 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.979 0.912 . . . . 75.12 110.342 173.099 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.3 pttt -144.99 141.25 28.78 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.339 0.656 . . . . 75.44 109.669 172.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 49.8 mm-40 -127.38 119.62 26.61 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 107.89 -1.152 . . . . 62.55 107.89 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 60.7 t30 -83.13 119.19 24.2 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 108.651 -0.87 . . . . 62.25 108.651 175.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -107.88 117.69 34.77 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 124.017 0.927 . . . . 72.01 109.303 177.018 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 59.0 m -84.43 100.43 11.32 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 107.909 -1.145 . . . . 72.25 107.909 168.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.452 HG22 HG23 ' A' ' 71' ' ' ILE . 57.6 t -91.99 103.83 14.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.447 0 N-CA-C 108.082 -1.081 . . . . 73.43 108.082 -179.557 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.519 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 30.1 mt-10 -79.01 102.13 8.18 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 114.57 -1.195 . . . . 73.43 108.723 -178.727 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.661 HG22 HG22 ' A' ' 68' ' ' VAL . 58.7 t -104.39 143.41 16.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 124.275 1.03 . . . . 74.42 108.894 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -136.14 147.83 47.92 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.462 0.705 . . . . 74.3 110.208 -179.047 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.5 tpp180 -76.57 117.58 18.36 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.785 0.834 . . . . 73.35 110.171 177.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -119.0 126.56 52.02 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 107.592 -1.262 . . . . 71.41 107.592 168.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 65.54 -104.5 1.0 Allowed Glycine 0 C--N 1.346 1.118 0 N-CA-C 111.122 -0.791 . . . . 72.12 111.122 -172.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -127.16 -5.06 6.14 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.89 0.876 . . . . 73.43 110.075 174.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 77.6 p -102.38 174.7 5.79 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.503 0.721 . . . . 73.31 111.171 -176.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -112.39 133.75 54.3 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.557 1.143 . . . . 74.3 110.637 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.1 t -128.23 151.99 48.62 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.26 1.024 . . . . 74.42 108.932 177.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.661 HG22 HG22 ' A' ' 59' ' ' VAL . 77.9 t -92.52 119.25 39.78 Favored 'Isoleucine or valine' 0 C--O 1.241 0.61 0 N-CA-C 109.941 -0.392 . . . . 74.23 109.941 175.312 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -70.07 -56.79 6.0 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 114.813 -1.085 . . . . 73.3 110.607 173.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -160.62 139.23 10.16 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 123.625 0.578 . . . . 64.4 110.02 178.01 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.452 HG23 HG22 ' A' ' 57' ' ' VAL . 59.3 mt -89.9 105.43 16.13 Favored 'Isoleucine or valine' 0 C--O 1.239 0.517 0 N-CA-C 107.975 -1.12 . . . . 73.44 107.975 168.292 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 96.1 m -97.14 105.85 18.08 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.485 0.714 . . . . 53.13 109.762 175.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 12.8 ttp180 -71.22 149.28 46.43 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 109.192 -0.67 . . . . 75.3 109.192 172.604 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 12.0 t -68.61 153.55 43.57 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 109.423 -0.584 . . . . 74.52 109.423 175.028 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 7.7 p -104.73 146.26 12.2 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 123.389 0.676 . . . . 73.3 109.341 179.172 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -148.9 138.73 7.08 Favored Glycine 0 C--N 1.337 0.608 0 N-CA-C 109.952 -1.259 . . . . 72.2 109.952 175.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 77.6 p -71.17 116.4 11.43 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.141 0.577 . . . . 55.12 110.213 -175.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.7 tt -106.46 49.7 0.8 Allowed 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 106.8 -1.555 . . . . 63.23 106.8 176.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.14 153.61 37.21 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 114.611 -1.177 . . . . 53.34 109.978 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 51.8 m80 -122.37 125.69 46.43 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 108.449 -0.945 . . . . 62.52 108.449 177.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -92.98 118.97 31.76 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 108.076 -1.083 . . . . 73.13 108.076 176.086 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -102.2 125.75 48.98 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 109.361 -0.607 . . . . 75.41 109.361 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 14.9 p80 -88.09 2.78 51.18 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.594 0.758 . . . . 65.21 111.512 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 69.0 t60 -103.26 115.68 31.02 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.841 0.856 . . . . 52.34 109.316 174.518 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 56.6 t-80 . . . . . 0 CA--C 1.557 1.244 0 N-CA-C 109.386 -0.598 . . . . 73.43 109.386 173.618 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 N--CA 1.485 1.288 0 CA-C-O 118.449 -0.786 . . . . 65.32 109.583 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_endo -44.01 110.54 0.21 Allowed 'Trans proline' 0 C--N 1.393 2.891 0 C-N-CA 124.126 3.217 . . . . 73.11 113.946 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 26.5 t -155.93 134.74 11.88 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.242 1.417 . . . . 72.54 107.466 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.493 ' HA ' ' HG2' ' A' ' 7' ' ' GLU . 20.4 tt0 -60.74 -29.0 69.12 Favored 'General case' 0 N--CA 1.481 1.088 0 O-C-N 123.41 0.444 . . . . 74.25 112.079 -170.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -64.88 -45.99 83.66 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.99 0.916 . . . . 75.45 110.676 173.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -66.75 -26.48 67.0 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.397 1.079 . . . . 65.23 110.626 177.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.543 ' O ' HG23 ' A' ' 11' ' ' VAL . 20.2 mm-40 -64.36 -39.73 94.45 Favored 'General case' 0 C--O 1.207 -1.162 0 CA-C-O 118.008 -0.996 . . . . 75.03 111.06 178.317 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.3 mptt -59.55 -36.4 76.11 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-N 119.319 0.963 . . . . 75.04 110.956 176.756 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -59.51 -31.33 69.27 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.281 0.632 . . . . 62.31 110.694 176.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.44 ' O ' HG23 ' A' ' 14' ' ' VAL . 39.2 mt-30 -82.45 -47.61 12.04 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 115.444 -0.798 . . . . 64.44 111.887 174.326 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.579 HG21 HD12 ' A' ' 40' ' ' ILE . 73.1 t -73.1 -45.5 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.186 0 C-N-CA 123.783 0.833 . . . . 54.24 112.08 -165.312 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.637 ' HD2' HG11 ' A' ' 30' ' ' VAL . 25.8 mtmm -69.43 -26.16 64.47 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 109.565 -0.532 . . . . 62.13 109.565 179.619 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.426 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 23.0 tt0 -71.34 -44.84 64.31 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.2 1.0 . . . . 63.41 110.318 176.741 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.465 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 82.6 t -61.51 -48.14 90.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 N-CA-C 108.85 -0.796 . . . . 63.01 108.85 174.341 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.9 -39.84 93.36 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.49 1.116 . . . . 75.24 112.228 -174.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -69.94 -38.05 76.07 Favored 'General case' 0 C--N 1.355 0.826 0 O-C-N 123.263 0.352 . . . . 74.24 110.278 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 28.2 mm-40 -68.23 -34.8 76.89 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 122.743 0.417 . . . . 74.5 110.618 177.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.638 ' HB3' HD11 ' A' ' 71' ' ' ILE . 31.7 mmmt -63.84 -33.0 74.71 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 122.952 0.501 . . . . 70.33 110.813 176.139 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.782 ' HB3' HD12 ' A' ' 46' ' ' LEU . 32.6 mt -76.15 -36.97 58.53 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.733 -0.667 . . . . 73.31 111.532 174.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.0 mt -73.58 -16.38 61.25 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.251 0.62 . . . . 64.13 111.614 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -61.77 -39.5 91.86 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.433 0.635 . . . . 55.3 110.508 167.538 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -84.8 -34.25 22.79 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 114.445 -1.252 . . . . 64.14 110.976 -175.524 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.425 ' HB3' HD11 ' A' ' 46' ' ' LEU . 15.2 t -153.03 88.81 3.77 Favored Pre-proline 0 CA--C 1.555 1.159 0 N-CA-C 109.169 -0.678 . . . . 71.31 109.169 -177.411 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -62.54 -44.57 17.33 Favored 'Trans proline' 0 C--N 1.384 2.418 0 C-N-CA 123.425 2.75 . . . . 72.3 114.36 -176.33 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -83.15 -2.99 56.88 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.359 0.663 . . . . 74.23 112.006 -171.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.6 t -83.74 158.39 21.79 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 122.922 0.489 . . . . 71.31 111.218 177.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.34 134.13 35.2 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 123.481 0.712 . . . . 70.12 109.86 177.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.432 ' HA ' ' O ' ' A' ' 45' ' ' GLU . 80.9 t -117.21 113.98 44.35 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 C-N-CA 123.522 0.729 . . . . 65.23 109.912 177.215 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -109.48 122.12 46.7 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.459 1.104 . . . . 60.42 109.062 172.322 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.637 HG11 ' HD2' ' A' ' 12' ' ' LYS . 57.5 t -65.79 116.33 4.92 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 N-CA-C 109.238 -0.653 . . . . 75.32 109.238 176.042 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.0 tpt180 -83.14 -51.89 7.11 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.389 0.676 . . . . 60.3 110.267 -174.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.401 ' HB2' ' HB2' ' A' ' 43' ' ' GLU . 37.1 mtp85 -146.0 156.4 43.47 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.6 1.16 . . . . 72.24 109.67 -177.522 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 75.1 t -132.64 117.62 31.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 C-N-CA 123.891 0.876 . . . . 65.3 108.839 175.259 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -112.91 128.44 56.47 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.21 0.604 . . . . 74.31 110.033 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.5 tptp -108.66 109.76 21.03 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.296 1.039 . . . . 73.2 108.792 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.0 mm-40 -132.1 103.17 6.12 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.426 0.69 . . . . 70.34 109.953 -178.013 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.34 -101.99 0.89 Allowed Glycine 0 C--N 1.356 1.676 0 CA-C-N 115.92 -0.582 . . . . 74.12 112.519 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -113.22 -23.22 10.07 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.524 0.73 . . . . 75.12 109.715 173.33 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 16.6 m -85.14 105.71 16.06 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.491 0.716 . . . . 65.21 110.437 -176.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.579 HD12 HG21 ' A' ' 11' ' ' VAL . 31.2 mt -85.46 108.1 16.86 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 N-CA-C 109.29 -0.633 . . . . 73.15 109.29 168.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 -87.71 95.93 10.25 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 108.458 -0.942 . . . . 64.42 108.458 175.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.5 t -88.15 118.38 33.66 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 N-CA-C 108.824 -0.806 . . . . 61.04 108.824 179.096 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.401 ' HB2' ' HB2' ' A' ' 32' ' ' ARG . 46.3 mt-10 -90.3 120.85 31.79 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 108.605 -0.887 . . . . 73.21 108.605 173.221 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.5 mp -122.44 170.05 10.36 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 109.728 -0.471 . . . . 65.43 109.728 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.586 ' HG3' ' HG3' ' A' ' 52' ' ' LYS . 29.4 tt0 -120.7 105.16 10.51 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.48 1.112 . . . . 64.34 108.695 -176.365 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.782 HD12 ' HB3' ' A' ' 19' ' ' LEU . 6.9 tt -107.27 133.83 51.25 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 106.402 -1.703 . . . . 73.53 106.402 172.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 87.1 mtt180 -99.86 96.84 7.84 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.834 0.826 . . . . 74.51 109.66 -174.096 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 30.2 m -89.76 115.83 27.4 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 114.669 -1.15 . . . . 54.4 109.032 -175.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 64.87 17.75 11.16 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.379 1.072 . . . . 74.52 111.103 -178.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 96.32 -16.96 60.15 Favored Glycine 0 C--N 1.353 1.491 0 CA-C-N 116.196 -0.456 . . . . 63.52 112.917 -175.573 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -79.39 145.49 33.35 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.738 0.815 . . . . 52.52 110.998 178.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.586 ' HG3' ' HG3' ' A' ' 45' ' ' GLU . 84.4 tttt -79.64 108.33 13.1 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 122.849 0.46 . . . . 73.43 109.766 175.382 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -111.89 118.87 36.71 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 107.851 -1.166 . . . . 71.4 107.851 172.133 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -88.06 132.9 34.11 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 109.878 -0.415 . . . . 44.2 109.878 177.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.439 ' CE2' ' HB3' ' A' ' 46' ' ' LEU . 66.6 m-85 -124.07 119.8 30.55 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 109.167 -0.679 . . . . 62.2 109.167 178.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 26.7 m -87.11 101.9 13.93 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 108.507 -0.923 . . . . 50.32 108.507 173.229 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.498 HG22 HG23 ' A' ' 71' ' ' ILE . 46.3 t -92.04 104.6 15.75 Favored 'Isoleucine or valine' 0 C--O 1.24 0.595 0 N-CA-C 108.007 -1.109 . . . . 55.4 108.007 177.51 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -80.93 105.24 12.01 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 114.511 -1.222 . . . . 75.55 109.344 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 20.8 t -112.91 134.57 55.11 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 108.806 -0.812 . . . . 73.43 108.806 178.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -121.95 142.71 50.02 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.302 0.641 . . . . 63.05 111.183 -174.268 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.85 114.92 19.14 Favored 'General case' 0 C--N 1.35 0.596 0 C-N-CA 123.787 0.835 . . . . 72.25 109.53 174.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -120.84 102.92 8.69 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 107.647 -1.242 . . . . 65.41 107.647 172.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 72.66 -99.53 0.92 Allowed Glycine 0 C--N 1.347 1.177 0 N-CA-C 110.211 -1.156 . . . . 74.43 110.211 -172.376 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -122.48 -19.19 6.45 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.303 1.041 . . . . 72.02 110.261 169.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 68.1 p -76.79 136.97 38.99 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 122.911 0.485 . . . . 75.22 111.364 -175.294 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -96.23 111.81 23.75 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.07 0.948 . . . . 75.23 109.891 177.18 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.2 t -105.01 139.73 39.25 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.734 0.814 . . . . 75.14 109.844 -177.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.488 HG21 ' HG3' ' A' ' 18' ' ' LYS . 59.0 t -91.14 116.65 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 O-C-N 121.709 -0.619 . . . . 71.43 110.379 177.198 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -71.37 -57.38 4.51 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.532 1.133 . . . . 54.13 111.091 175.593 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -162.09 133.53 5.29 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.584 -0.734 . . . . 50.5 109.844 -173.031 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.638 HD11 ' HB3' ' A' ' 18' ' ' LYS . 56.5 mt -91.48 105.21 16.3 Favored 'Isoleucine or valine' 0 C--O 1.241 0.614 0 N-CA-C 106.636 -1.616 . . . . 73.33 106.636 163.711 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 27.2 m -101.25 108.46 20.12 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.108 -0.701 . . . . 61.23 109.108 -176.524 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -67.54 138.67 56.68 Favored 'General case' 0 C--O 1.241 0.625 0 N-CA-C 108.81 -0.811 . . . . 74.02 108.81 171.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.1 t -60.02 156.53 14.59 Favored 'General case' 0 C--O 1.247 0.934 0 C-N-CA 123.58 0.752 . . . . 73.25 110.605 175.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 85.0 t -61.42 99.72 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.348 0.5 0 N-CA-C 108.826 -0.805 . . . . 72.23 108.826 177.157 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -96.98 -139.12 10.45 Favored Glycine 0 C--N 1.34 0.795 0 CA-C-N 115.024 -0.989 . . . . 74.01 111.064 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 31.4 t -154.1 162.22 41.35 Favored 'General case' 0 C--O 1.248 1.015 0 N-CA-C 108.437 -0.949 . . . . 53.34 108.437 176.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.0 pp -57.92 137.17 56.98 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 109.436 -0.579 . . . . 64.14 109.436 172.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -78.35 148.67 33.65 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 109.747 -0.464 . . . . 75.31 109.747 -175.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -63.59 104.95 0.71 Allowed 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 107.99 -1.115 . . . . 73.41 107.99 174.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 35.2 p-80 -61.34 118.38 6.85 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 124.277 0.985 . . . . 60.24 111.822 -167.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 32.9 p-80 -78.91 -9.66 59.57 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 115.047 -0.979 . . . . 64.45 110.154 172.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 81.2 t60 -57.9 109.09 0.67 Allowed 'General case' 0 C--N 1.359 1.011 0 C-N-CA 124.665 1.186 . . . . 72.22 109.669 168.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 34.2 m80 -133.81 103.08 5.69 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 123.683 0.793 . . . . 75.22 110.105 -176.462 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 47.6 t60 . . . . . 0 CA--C 1.556 1.173 0 N-CA-C 107.881 -1.155 . . . . 72.24 107.881 176.356 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 119.065 -0.493 . . . . 70.33 109.842 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -56.49 121.82 10.71 Favored 'Trans proline' 0 C--N 1.377 2.05 0 C-N-CA 121.897 1.731 . . . . 62.51 110.864 168.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.569 ' O ' ' HG3' ' A' ' 7' ' ' GLU . 22.3 t -60.84 -23.85 65.44 Favored 'General case' 0 C--O 1.212 -0.87 0 C-N-CA 123.229 0.612 . . . . 64.14 110.61 178.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.2 tp10 -51.33 -47.22 62.77 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.134 1.374 . . . . 75.41 111.651 173.088 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -75.2 -39.86 59.79 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.201 0.6 . . . . 75.51 110.403 177.547 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.424 ' HA ' ' HD2' ' A' ' 9' ' ' ARG . 11.7 tp10 -66.47 -22.17 66.2 Favored 'General case' 0 C--O 1.245 0.816 0 CA-C-N 115.108 -0.951 . . . . 74.23 111.312 -176.277 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.569 ' HG3' ' O ' ' A' ' 3' ' ' SER . 72.9 mt-10 -50.5 -66.74 0.34 Allowed 'General case' 0 C--N 1.364 1.205 0 O-C-N 124.022 0.826 . . . . 70.35 109.981 173.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.478 ' HD2' ' HB2' ' A' ' 7' ' ' GLU . 10.6 mptt -66.0 -27.82 68.42 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 123.908 0.755 . . . . 70.22 111.295 -169.453 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.424 ' HD2' ' HA ' ' A' ' 6' ' ' GLU . 90.5 mtt180 -59.71 -40.14 86.94 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.091 0.556 . . . . 72.52 110.398 176.295 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -77.91 -51.38 10.51 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 115.107 -0.951 . . . . 64.43 110.751 173.589 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.546 HG23 ' O ' ' A' ' 7' ' ' GLU . 52.0 t -66.04 -44.77 91.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 123.653 0.781 . . . . 64.43 112.486 -164.617 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.403 ' HD2' HG11 ' A' ' 30' ' ' VAL . 29.1 mtmm -66.05 -31.97 73.16 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 123.165 0.29 . . . . 71.42 110.394 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.412 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 58.5 tt0 -70.76 -43.82 68.01 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 124.107 0.879 . . . . 74.3 110.185 178.416 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.479 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 87.8 t -65.08 -39.83 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 N-CA-C 109.557 -0.534 . . . . 64.14 109.557 176.023 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.91 -44.2 81.37 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.198 0.999 . . . . 71.51 111.598 -175.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -67.85 -34.82 77.45 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 123.793 0.683 . . . . 75.44 110.164 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.484 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 22.4 mm-40 -61.01 -46.02 92.46 Favored 'General case' 0 C--N 1.356 0.848 0 O-C-N 123.633 0.583 . . . . 65.54 111.077 177.537 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.607 ' HB3' HD11 ' A' ' 71' ' ' ILE . 71.5 mmtt -67.22 -30.66 70.65 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.669 0.606 . . . . 75.45 111.09 -178.466 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.565 ' HB3' HD12 ' A' ' 46' ' ' LEU . 41.7 mt -70.15 -36.26 74.62 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.396 0.678 . . . . 64.24 111.442 174.29 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.3 mt -76.06 -22.89 55.15 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 123.764 0.826 . . . . 55.21 110.57 176.185 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 7.4 mm-40 -69.15 -36.94 77.97 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.261 0.624 . . . . 75.14 110.147 171.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -76.16 -42.06 47.86 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.21 0.604 . . . . 73.12 110.944 176.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.4 t -148.85 96.71 3.75 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 123.062 0.545 . . . . 73.12 110.368 -174.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -82.55 -1.98 10.83 Favored 'Trans proline' 0 C--N 1.372 1.805 0 C-N-CA 123.228 2.619 . . . . 71.4 112.434 172.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -83.41 -3.88 57.97 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.671 1.188 . . . . 61.11 111.676 178.492 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 34.4 p -127.09 142.56 51.49 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.382 0.673 . . . . 74.42 111.979 -168.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -77.85 136.43 38.07 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 123.818 0.699 . . . . 73.25 109.587 169.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 60.3 t -112.61 134.99 53.43 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 C-N-CA 123.973 0.909 . . . . 74.03 108.938 177.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -128.95 149.6 50.73 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.826 0.851 . . . . 70.11 109.396 176.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.403 HG11 ' HD2' ' A' ' 12' ' ' LYS . 73.8 t -77.05 110.35 12.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 N-CA-C 109.96 -0.385 . . . . 73.54 109.96 176.189 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -81.44 -59.57 2.58 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.656 0.782 . . . . 63.12 110.09 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.424 ' HB2' ' HB2' ' A' ' 43' ' ' GLU . 17.6 mmm180 -148.82 167.26 26.12 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.885 1.274 . . . . 70.2 108.981 -176.276 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.403 HG22 HG13 ' A' ' 42' ' ' VAL . 59.2 t -135.45 139.76 46.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 N-CA-C 108.704 -0.85 . . . . 62.13 108.704 171.179 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -125.6 108.25 11.39 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 109.112 -0.699 . . . . 75.04 109.112 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -96.43 113.51 25.1 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 107.972 -1.122 . . . . 74.04 107.972 176.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 92.4 mm-40 -131.96 99.05 4.61 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.879 -0.786 . . . . 74.51 108.879 176.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 63.06 -102.53 0.53 Allowed Glycine 0 C--N 1.348 1.238 0 O-C-N 124.386 1.054 . . . . 72.3 112.908 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -97.15 -39.76 9.13 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.571 0.748 . . . . 63.22 109.838 174.353 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.438 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 11.5 m -80.69 96.42 6.9 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 123.296 0.638 . . . . 60.31 110.803 -172.061 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 28.8 mt -87.54 107.32 17.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 115.779 -0.646 . . . . 64.02 109.357 168.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 31.6 mtm180 -87.82 96.07 10.33 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 108.01 -1.107 . . . . 72.22 108.01 174.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.403 HG13 HG22 ' A' ' 33' ' ' VAL . 48.6 t -82.59 121.17 35.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 N-CA-C 109.034 -0.728 . . . . 74.41 109.034 177.073 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.424 ' HB2' ' HB2' ' A' ' 32' ' ' ARG . 37.6 mt-10 -89.45 118.11 28.86 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.416 -0.811 . . . . 74.15 109.095 176.116 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.8 mp -122.99 164.04 19.29 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 108.823 -0.806 . . . . 74.12 108.823 176.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -125.56 111.82 15.48 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.633 0.773 . . . . 70.52 108.916 -169.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.565 HD12 ' HB3' ' A' ' 19' ' ' LEU . 8.5 tt -120.41 137.68 54.18 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.173 1.389 . . . . 62.14 108.361 -171.733 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 14.5 mtm180 -101.18 97.83 8.31 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 109.476 -0.565 . . . . 74.22 109.476 -178.507 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 8.0 m -82.35 105.25 13.27 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.2 0.6 . . . . 62.13 110.054 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 50.0 m-20 59.07 34.37 23.39 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.527 1.131 . . . . 73.01 111.783 177.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 96.73 -17.07 59.92 Favored Glycine 0 C--N 1.349 1.274 0 CA-C-N 115.865 -0.607 . . . . 75.23 113.488 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -85.79 121.07 27.92 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 117.511 0.655 . . . . 71.54 109.626 177.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -86.78 98.43 11.16 Favored 'General case' 0 C--O 1.241 0.629 0 N-CA-C 108.983 -0.747 . . . . 71.21 108.983 -176.218 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -108.59 134.61 51.11 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.907 0.883 . . . . 72.13 110.399 -175.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -88.43 120.87 30.21 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.633 -0.712 . . . . 74.54 110.525 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.517 ' CE2' ' HB3' ' A' ' 46' ' ' LEU . 19.1 m-85 -104.71 157.8 16.94 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.02 0.928 . . . . 65.31 109.801 177.496 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 85.3 m -134.23 103.04 5.59 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 107.984 -1.117 . . . . 70.33 107.984 173.575 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.43 HG22 HG23 ' A' ' 71' ' ' ILE . 52.0 t -90.1 105.25 16.01 Favored 'Isoleucine or valine' 0 C--O 1.241 0.647 0 N-CA-C 107.56 -1.274 . . . . 74.32 107.56 -179.446 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -77.12 111.27 12.54 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 114.891 -1.049 . . . . 62.31 109.129 -179.804 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 24.7 t -122.81 122.59 66.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 123.635 0.774 . . . . 51.01 109.39 -178.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.438 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 29.8 tt0 -105.85 145.57 31.05 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.114 0.965 . . . . 72.3 110.859 -176.213 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 14.5 tpp180 -75.42 121.25 22.02 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 109.782 -0.451 . . . . 75.1 109.782 171.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -117.39 101.8 8.7 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.503 -0.925 . . . . 72.14 108.503 167.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.75 -106.24 1.76 Allowed Glycine 0 C--N 1.348 1.239 0 CA-C-N 115.96 -0.564 . . . . 64.32 111.98 -178.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -108.98 -19.71 13.3 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.342 0.657 . . . . 64.32 110.296 177.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.2 p -93.76 173.88 7.46 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.465 0.65 . . . . 70.24 111.442 -178.15 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -116.08 150.55 37.15 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.479 1.111 . . . . 73.15 109.442 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.3 t -134.77 123.15 23.14 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 109.457 -0.571 . . . . 72.34 109.457 -179.441 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.557 HG21 ' HG3' ' A' ' 18' ' ' LYS . 95.5 t -74.93 103.67 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 N-CA-C 108.812 -0.81 . . . . 72.24 108.812 175.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.5 mmmp? -64.4 -52.77 56.54 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 123.934 0.894 . . . . 74.03 110.196 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -163.62 152.61 14.17 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.464 -0.789 . . . . 64.3 109.895 178.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.607 HD11 ' HB3' ' A' ' 18' ' ' LYS . 70.5 mt -101.95 110.14 27.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 N-CA-C 108.029 -1.1 . . . . 72.04 108.029 170.086 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 17.4 m -91.65 142.8 27.23 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 108.542 -0.91 . . . . 54.01 108.542 178.079 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 27.9 ttp180 -118.31 144.33 45.93 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 107.536 -1.283 . . . . 63.21 107.536 168.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.4 t -58.28 144.79 40.01 Favored 'General case' 0 C--O 1.248 0.996 0 C-N-CA 122.943 0.497 . . . . 75.53 109.994 176.294 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 58.8 t -60.69 99.83 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 N-CA-C 108.621 -0.881 . . . . 63.45 108.621 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -139.55 7.36 3.06 Favored Glycine 0 CA--C 1.51 -0.232 0 CA-C-N 114.642 -1.163 . . . . 71.55 110.746 176.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 16.6 m -68.3 84.1 0.25 Allowed 'General case' 0 C--N 1.353 0.747 0 C-N-CA 124.264 1.026 . . . . 42.11 110.004 177.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.86 153.72 40.91 Favored 'General case' 0 C--O 1.244 0.802 0 CA-C-N 115.379 -0.828 . . . . 72.05 110.746 179.159 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -67.17 140.23 57.48 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.794 -0.639 . . . . 52.51 111.158 -175.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 45.5 p-80 -137.66 147.26 44.76 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-N 115.148 -0.933 . . . . 71.53 108.862 174.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 50.6 m80 -72.84 150.43 42.69 Favored 'General case' 0 C--O 1.242 0.704 0 C-N-CA 123.577 0.751 . . . . 74.1 111.747 -175.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 38.2 t60 -66.72 101.02 0.75 Allowed 'General case' 0 C--N 1.346 0.445 0 CA-C-N 115.135 -0.938 . . . . 73.33 108.818 171.357 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 78.6 m80 -58.31 143.26 45.4 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.837 0.855 . . . . 75.03 110.206 177.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 48.2 t-80 66.32 87.32 0.12 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.486 1.114 . . . . 70.01 108.931 -170.48 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 11.8 p80 . . . . . 0 C--O 1.253 1.289 0 C-N-CA 123.616 0.766 . . . . 61.12 110.021 -172.706 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.2 ttm . . . . . 0 N--CA 1.481 1.105 0 N-CA-C 109.042 -0.725 . . . . 73.24 109.042 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -80.92 82.6 2.42 Favored 'Trans proline' 0 C--N 1.373 1.852 0 C-N-CA 122.753 2.302 . . . . 72.02 112.164 178.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.515 ' HB3' ' HG3' ' A' ' 6' ' ' GLU . 38.6 t -66.43 137.28 56.73 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-N 115.843 -0.617 . . . . 75.4 109.764 177.078 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -68.4 -19.8 64.63 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 115.943 -0.572 . . . . 42.33 111.224 179.015 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -66.55 -36.74 83.4 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.886 0.874 . . . . 71.24 110.706 173.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.515 ' HG3' ' HB3' ' A' ' 3' ' ' SER . 45.2 mt-10 -59.41 -33.57 71.4 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.39 0.676 . . . . 74.35 110.348 177.426 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.509 ' O ' HG23 ' A' ' 11' ' ' VAL . 51.1 mm-40 -63.47 -40.93 98.42 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 123.899 0.749 . . . . 75.13 111.35 178.663 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.19 -41.65 98.55 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.247 0.619 . . . . 61.55 110.32 179.43 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -58.83 -44.79 90.97 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 124.026 0.93 . . . . 72.12 110.822 175.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.452 ' O ' HG23 ' A' ' 14' ' ' VAL . 68.5 mt-30 -62.96 -45.11 93.97 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 114.904 -1.044 . . . . 74.44 111.089 179.249 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.52 HG21 HD12 ' A' ' 40' ' ' ILE . 87.6 t -66.71 -43.51 90.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 123.621 0.769 . . . . 73.34 111.423 -176.309 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -61.45 -37.69 84.49 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 123.486 0.491 . . . . 75.54 110.442 176.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.512 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.5 tt0 -65.79 -49.14 69.38 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 124.119 0.887 . . . . 74.43 110.323 179.03 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 10' ' ' GLN . 89.0 t -58.12 -45.69 88.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 C-N-CA 123.068 0.547 . . . . 62.34 109.784 176.341 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.84 -42.29 97.63 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.175 0.99 . . . . 51.41 112.179 -175.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -73.72 -35.44 65.09 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 116.317 -0.401 . . . . 72.34 110.667 -176.314 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 25.3 mm-40 -65.87 -37.13 85.33 Favored 'General case' 0 C--N 1.353 0.732 0 O-C-N 123.422 0.451 . . . . 75.33 110.369 176.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.634 ' HB3' HD11 ' A' ' 71' ' ' ILE . 65.9 mmtt -63.26 -37.1 85.94 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.347 0.659 . . . . 74.53 110.897 176.218 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 23.8 mt -72.49 -30.65 64.71 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 115.85 -0.614 . . . . 64.42 111.414 176.086 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 75.5 mt -76.19 -19.68 58.2 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.333 0.653 . . . . 64.31 111.045 177.127 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -77.0 -21.12 55.17 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.018 0.527 . . . . 71.22 110.714 170.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 -88.64 -38.12 15.06 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.165 0.586 . . . . 73.25 110.226 175.293 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.8 t -157.31 102.51 1.87 Allowed Pre-proline 0 CA--C 1.552 1.048 0 C-N-CA 124.208 1.003 . . . . 42.32 109.215 -176.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -77.04 -27.61 6.69 Favored 'Trans proline' 0 C--N 1.373 1.824 0 C-N-CA 122.796 2.331 . . . . 74.24 112.851 -176.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -74.46 -27.93 60.8 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.766 0.826 . . . . 62.54 111.18 -173.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 54.5 m -80.47 130.04 34.9 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 123.299 0.64 . . . . 74.13 111.373 -174.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -73.67 123.49 24.15 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 123.509 0.724 . . . . 75.14 109.697 175.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.54 HG22 HD12 ' A' ' 46' ' ' LEU . 40.8 t -99.68 113.29 34.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 123.315 0.646 . . . . 74.34 109.617 -177.074 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -94.61 151.72 19.09 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.945 -0.761 . . . . 52.11 108.945 174.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 p -87.09 105.75 15.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 N-CA-C 108.936 -0.765 . . . . 62.44 108.936 171.552 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -77.21 -42.7 36.41 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.249 0.62 . . . . 72.41 110.435 -177.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 17.5 tpp85 -170.01 155.55 5.63 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.976 0.91 . . . . 61.31 109.452 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 25.2 t -117.21 117.19 54.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.354 -0.98 . . . . 70.15 108.354 171.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -104.55 145.59 30.09 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 109.423 -0.584 . . . . 61.22 109.423 174.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.565 ' HG2' HG12 ' A' ' 40' ' ' ILE . 13.2 tmtt? -136.53 117.25 13.99 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 107.166 -1.42 . . . . 74.13 107.166 -177.824 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -133.25 96.3 3.71 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.082 0.953 . . . . 63.51 108.733 -175.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.47 -92.76 0.28 Allowed Glycine 0 C--N 1.348 1.248 0 O-C-N 123.555 0.535 . . . . 72.53 112.215 -177.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.43 ' HB3' ' HB3' ' A' ' 61' ' ' ARG . 47.6 m-80 -114.18 -25.23 8.57 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.971 0.909 . . . . 75.23 110.741 175.079 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.567 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 19.9 m -81.79 103.8 11.73 Favored 'General case' 0 C--O 1.24 0.587 0 C-N-CA 123.158 0.583 . . . . 75.11 111.252 -176.528 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.565 HG12 ' HG2' ' A' ' 35' ' ' LYS . 39.6 mt -86.76 107.12 16.54 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 N-CA-C 109.063 -0.717 . . . . 63.31 109.063 168.4 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.425 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 95.0 mtt180 -92.29 96.72 10.45 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 108.406 -0.961 . . . . 73.34 108.406 176.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.412 HG12 ' HG ' ' A' ' 44' ' ' LEU . 39.2 t -80.25 120.7 32.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 N-CA-C 108.421 -0.955 . . . . 54.34 108.421 176.614 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -84.89 115.49 22.8 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 107.482 -1.303 . . . . 74.53 107.482 170.159 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.412 ' HG ' HG12 ' A' ' 42' ' ' VAL . 1.9 mp -117.82 142.87 46.82 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 109.594 -0.521 . . . . 73.5 109.594 178.669 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -107.2 104.82 14.55 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.916 0.886 . . . . 72.02 108.787 -175.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.54 HD12 HG22 ' A' ' 28' ' ' VAL . 8.3 tt -117.2 135.46 53.77 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.323 1.049 . . . . 60.3 108.747 -175.85 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 64.6 mtm180 -103.0 97.74 7.8 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 109.306 -0.627 . . . . 73.33 109.306 -178.395 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 89.1 m -76.35 96.44 4.0 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.655 0.782 . . . . 74.32 109.761 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 60.85 27.17 17.0 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.245 1.018 . . . . 61.03 111.328 -178.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 99.72 -8.09 59.67 Favored Glycine 0 C--N 1.354 1.537 0 CA-C-N 115.58 -0.736 . . . . 70.43 113.74 -179.247 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.513 ' HA ' ' HE2' ' A' ' 51' ' ' LYS . 11.0 mmpt? -83.75 124.23 30.67 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 117.402 0.601 . . . . 70.23 109.468 174.095 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -81.47 109.49 15.99 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.079 0.551 . . . . 73.21 110.208 -175.107 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -127.64 118.78 24.51 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.775 0.83 . . . . 72.2 109.815 -177.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -80.32 147.07 31.27 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.812 -0.81 . . . . 62.1 108.812 171.431 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 -129.88 120.57 25.13 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.762 0.825 . . . . 55.24 108.829 179.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 90.8 m -85.44 100.64 12.01 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 108.404 -0.962 . . . . 71.21 108.404 170.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.483 HG22 HG23 ' A' ' 71' ' ' ILE . 43.4 t -97.52 102.87 13.99 Favored 'Isoleucine or valine' 0 C--O 1.243 0.728 0 N-CA-C 107.591 -1.263 . . . . 72.25 107.591 175.075 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.425 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 31.7 mt-10 -80.57 101.52 9.21 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 114.319 -1.31 . . . . 73.24 108.483 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.502 ' HB ' HG13 ' A' ' 11' ' ' VAL . 21.2 t -109.39 109.45 28.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 N-CA-C 107.84 -1.17 . . . . 71.01 107.84 177.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.567 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 45.8 tt0 -101.9 146.34 27.97 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.729 0.811 . . . . 75.41 109.767 -175.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.43 ' HB3' ' HB3' ' A' ' 38' ' ' ASN . 8.6 tpt180 -80.49 111.24 16.72 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.659 0.784 . . . . 73.11 110.595 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 -106.11 93.5 4.65 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 108.398 -0.964 . . . . 55.23 108.398 174.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.08 -100.69 0.73 Allowed Glycine 0 C--N 1.344 1.011 0 CA-C-N 115.549 -0.75 . . . . 44.45 112.045 -177.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -105.65 -26.08 11.99 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.23 1.012 . . . . 73.41 110.831 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.2 p -93.61 160.65 14.68 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.579 0.752 . . . . 73.13 111.686 -174.098 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -108.16 109.81 21.3 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.625 1.17 . . . . 74.41 109.821 176.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 9.8 t -103.83 127.67 51.31 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.67 0.788 . . . . 71.14 110.712 -178.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.467 HG22 HG22 ' A' ' 59' ' ' VAL . 63.6 t -77.51 110.14 12.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 N-CA-C 109.617 -0.512 . . . . 64.01 109.617 176.551 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -69.05 -49.52 56.81 Favored 'General case' 0 C--O 1.24 0.58 0 C-N-CA 123.363 0.665 . . . . 74.11 110.534 178.153 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -166.69 143.1 4.66 Favored 'General case' 0 C--N 1.348 0.501 0 CA-C-N 116.291 -0.413 . . . . 73.2 111.49 177.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.634 HD11 ' HB3' ' A' ' 18' ' ' LYS . 56.8 mt -97.84 106.95 19.37 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 N-CA-C 107.739 -1.208 . . . . 73.13 107.739 166.442 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 37.4 m -102.51 119.73 39.31 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.307 0.643 . . . . 75.41 109.48 178.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 28.4 ttp180 -75.93 148.08 38.47 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 109.331 -0.618 . . . . 74.43 109.331 176.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.4 t -54.2 137.15 41.52 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 124.394 1.078 . . . . 71.14 112.616 -173.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 45.9 t -69.27 103.51 0.84 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.606 0 CA-C-N 115.382 -0.826 . . . . 63.13 108.946 176.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 163.72 -37.84 0.32 Allowed Glycine 0 C--O 1.239 0.438 0 N-CA-C 109.47 -1.452 . . . . 75.22 109.47 -172.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 20.9 t -87.92 178.01 6.81 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 123.689 0.796 . . . . 63.41 109.913 172.187 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.3 tt -136.24 117.67 14.74 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 108.141 -1.059 . . . . 70.35 108.141 -177.37 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -79.94 97.67 6.84 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 107.995 -1.113 . . . . 33.13 107.995 172.059 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 29.5 p80 -64.79 154.13 37.89 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.8 0.44 . . . . 74.01 111.765 -170.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 72.2 m-70 -69.82 153.59 43.12 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.519 0.728 . . . . 72.43 111.389 -176.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -96.55 119.11 34.44 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.088 -0.96 . . . . 60.43 109.003 -175.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 41.4 t60 -70.09 108.02 3.91 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 108.587 -0.894 . . . . 73.23 108.587 174.344 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 14.3 p80 -67.5 125.84 27.42 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 122.672 0.389 . . . . 62.11 110.211 -175.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 21.7 p80 . . . . . 0 C--O 1.251 1.146 0 CA-C-N 116.038 -0.528 . . . . 73.04 109.848 174.256 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.1 mmt . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 119.353 -0.356 . . . . 71.53 110.452 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -56.42 -39.04 93.97 Favored 'Trans proline' 0 C--N 1.383 2.361 0 C-N-CA 123.238 2.626 . . . . 60.21 112.792 175.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 29.8 m -83.84 104.73 14.17 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.451 -0.795 . . . . 70.11 109.344 177.376 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -78.65 -36.54 43.77 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.083 0.953 . . . . 71.24 110.73 -174.552 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -67.21 -35.52 79.78 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-O 120.948 0.404 . . . . 60.44 110.221 178.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -51.35 -42.0 60.99 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.04 1.336 . . . . 65.14 111.769 -178.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.506 ' O ' HG23 ' A' ' 11' ' ' VAL . 9.8 mm-40 -57.42 -43.32 83.7 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.987 0.915 . . . . 72.43 111.914 -175.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.454 ' HD2' ' N ' ' A' ' 8' ' ' LYS . 10.5 mptt -68.76 -48.21 64.3 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 108.872 -0.788 . . . . 74.12 108.872 -179.276 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -59.13 -34.53 72.16 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.697 1.199 . . . . 61.25 112.117 -177.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 61.7 mt-30 -70.89 -53.62 14.45 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.633 0.773 . . . . 72.22 110.817 178.349 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.64 HG13 ' HB ' ' A' ' 59' ' ' VAL . 59.8 t -63.36 -44.59 99.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 123.27 0.628 . . . . 75.31 111.639 -172.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.607 ' HD2' HG11 ' A' ' 30' ' ' VAL . 48.2 mtmt -66.02 -33.8 76.63 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.396 0.679 . . . . 74.31 110.592 -179.376 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.509 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.4 tt0 -66.45 -59.11 3.97 Favored 'General case' 0 C--N 1.355 0.811 0 O-C-N 123.96 0.788 . . . . 63.34 109.699 176.215 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.4 t -52.49 -44.77 45.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 C-N-CA 124.435 1.094 . . . . 70.4 111.129 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.431 ' HB1' HD11 ' A' ' 44' ' ' LEU . . . -61.69 -42.05 98.41 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.282 1.033 . . . . 62.22 111.646 -179.392 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.407 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 32.3 tttm -65.54 -43.72 89.09 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.441 1.096 . . . . 61.3 110.719 175.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 15.7 mm-40 -61.24 -41.91 97.71 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 123.843 0.715 . . . . 74.15 110.573 -177.327 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.433 ' HB3' HD11 ' A' ' 71' ' ' ILE . 69.6 mmtt -64.56 -41.52 96.26 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 124.196 0.935 . . . . 75.11 110.966 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 77.3 mt -70.17 -27.61 64.66 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.0 0.52 . . . . 75.01 111.733 177.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 90.6 mt -73.63 -33.89 64.75 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.436 0.694 . . . . 40.12 110.36 174.359 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -71.1 -36.68 72.26 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.475 0.71 . . . . 74.13 110.783 177.468 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -76.43 -35.55 58.45 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.558 0.743 . . . . 74.42 111.457 178.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 29.8 t -148.24 93.74 4.35 Favored Pre-proline 0 CA--C 1.55 0.971 0 N-CA-C 109.433 -0.58 . . . . 70.23 109.433 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -76.0 -4.07 14.67 Favored 'Trans proline' 0 C--N 1.378 2.119 0 C-N-CA 122.792 2.328 . . . . 71.42 112.867 173.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -83.07 -19.46 36.8 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.055 0.942 . . . . 73.54 110.059 173.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.441 ' HA ' ' HB ' ' A' ' 48' ' ' THR . 39.4 t -86.45 141.02 29.43 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 123.386 0.675 . . . . 75.52 112.325 -173.344 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -89.87 108.93 20.0 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 107.3 -1.37 . . . . 74.13 107.3 164.581 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 88.6 t -98.48 113.37 32.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 C-N-CA 123.82 0.848 . . . . 74.34 109.206 -176.111 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 61.3 tp60 -117.87 124.21 47.75 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.578 0.751 . . . . 75.43 109.811 -178.033 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.607 HG11 ' HD2' ' A' ' 12' ' ' LYS . 55.8 t -62.8 108.1 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 N-CA-C 109.309 -0.626 . . . . 75.43 109.309 174.348 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 24.1 tpt85 -88.43 -36.27 16.6 Favored 'General case' 0 CA--C 1.549 0.915 0 CA-C-N 115.28 -0.873 . . . . 72.24 111.607 -175.036 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -170.0 165.49 9.44 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.328 0.651 . . . . 71.11 109.336 -177.586 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.499 HG21 ' HD3' ' A' ' 12' ' ' LYS . 97.5 t -141.69 123.44 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 124.012 0.925 . . . . 72.51 109.594 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -101.31 109.99 21.92 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.209 0.604 . . . . 72.41 109.537 170.345 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.512 ' HG2' HG12 ' A' ' 40' ' ' ILE . 6.2 tmtm? -99.09 108.53 21.19 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 108.303 -0.999 . . . . 64.35 108.303 179.747 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 33.8 mm-40 -126.99 99.4 5.7 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.804 0.842 . . . . 73.41 110.413 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.04 -120.78 17.06 Favored Glycine 0 C--N 1.356 1.654 0 CA-C-N 115.322 -0.854 . . . . 73.23 112.641 176.014 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -77.05 -35.03 57.11 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.521 0.728 . . . . 74.11 110.654 178.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.458 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 89.5 m -87.95 126.39 35.03 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-O 121.319 0.58 . . . . 65.42 110.216 -175.502 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.512 HG12 ' HG2' ' A' ' 35' ' ' LYS . 33.3 mt -115.27 107.94 24.07 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 N-CA-C 107.836 -1.172 . . . . 54.3 107.836 173.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.582 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 94.4 mtt180 -83.31 131.62 35.07 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 123.905 0.882 . . . . 75.14 108.674 173.379 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.483 HG13 HG22 ' A' ' 33' ' ' VAL . 35.5 t -118.81 116.83 52.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 108.634 -0.876 . . . . 74.11 108.634 175.247 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -83.68 103.68 13.19 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 107.869 -1.159 . . . . 75.21 107.869 172.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.434 ' HG ' HG12 ' A' ' 42' ' ' VAL . 0.6 OUTLIER -109.6 166.85 10.58 Favored 'General case' 0 N--CA 1.484 1.235 0 N-CA-C 107.963 -1.125 . . . . 71.13 107.963 173.458 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -122.12 125.83 47.03 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.816 0.341 . . . . 72.35 110.255 -173.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.4 ' HG ' ' OG ' ' A' ' 26' ' ' SER . 10.0 tt -96.85 115.57 27.66 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.911 1.284 . . . . 70.51 107.692 -177.817 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -120.79 105.92 11.19 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.962 0.905 . . . . 74.02 110.222 -177.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.441 ' HB ' ' HA ' ' A' ' 26' ' ' SER . 12.7 t -158.72 135.69 9.73 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.146 0.579 . . . . 74.21 110.057 176.19 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 15.1 m120 60.95 22.83 12.98 Favored 'General case' 0 N--CA 1.499 2.017 0 C-N-CA 124.227 1.011 . . . . 65.54 112.534 176.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 85.91 2.36 86.37 Favored Glycine 0 C--N 1.354 1.58 0 CA-C-O 119.956 -0.358 . . . . 41.31 113.396 -176.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 2.1 mmmp? -84.49 127.11 33.85 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.882 0.873 . . . . 74.42 108.75 174.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -136.04 99.15 4.06 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 107.579 -1.267 . . . . 74.44 107.579 -178.078 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -138.32 130.97 29.32 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.862 0.865 . . . . 63.13 109.78 -178.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 35.6 m-80 -83.4 127.23 33.51 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.352 0.661 . . . . 53.31 110.61 178.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -106.5 119.98 40.72 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.985 0.914 . . . . 72.44 109.351 176.239 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 80.5 m -86.7 101.7 13.53 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 124.762 1.225 . . . . 62.32 108.817 172.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.546 HG22 HG23 ' A' ' 71' ' ' ILE . 45.5 t -93.31 105.45 16.84 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 N-CA-C 108.437 -0.949 . . . . 63.24 108.437 179.124 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.582 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 33.6 mt-10 -77.94 112.15 14.54 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.796 0.839 . . . . 61.25 108.774 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.64 ' HB ' HG13 ' A' ' 11' ' ' VAL . 17.6 t -124.66 115.31 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 N-CA-C 108.573 -0.899 . . . . 33.34 108.573 177.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.459 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 29.4 tt0 -100.7 148.3 25.03 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.069 0.948 . . . . 74.34 110.233 -176.516 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.12 114.13 19.76 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 109.262 -0.644 . . . . 73.12 109.262 176.161 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 -119.81 86.61 2.59 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 124.275 1.03 . . . . 65.15 108.276 177.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 68.55 -132.37 27.17 Favored Glycine 0 C--N 1.346 1.101 0 CA-C-N 115.692 -0.685 . . . . 61.14 111.631 -175.735 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -80.59 -2.17 45.25 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.714 0.806 . . . . 55.13 111.721 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 73.8 p -114.56 150.96 34.16 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.084 0.554 . . . . 74.45 110.563 -176.086 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 96.3 m95 -98.32 119.18 36.55 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.056 0.942 . . . . 75.42 108.827 168.675 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 10.0 t -103.13 121.29 42.32 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.442 0.697 . . . . 72.0 109.875 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 51.2 t -76.29 106.97 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 108.494 -0.928 . . . . 75.22 108.494 176.379 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.459 ' HD3' ' HB3' ' A' ' 60' ' ' GLU . 1.5 mmmp? -65.02 -57.13 9.49 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 115.589 -0.732 . . . . 61.35 110.128 -179.352 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 63.1 ttt180 -167.26 136.25 2.71 Favored 'General case' 0 C--N 1.352 0.676 0 CA-C-N 116.008 -0.542 . . . . 75.24 110.597 178.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.546 HG23 HG22 ' A' ' 57' ' ' VAL . 71.9 mt -87.35 105.91 15.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 107.653 -1.24 . . . . 73.41 107.653 171.763 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 19.6 m -107.07 115.5 30.29 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.341 0.656 . . . . 75.54 109.506 -174.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -68.84 149.9 48.42 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.015 0.526 . . . . 71.52 109.753 172.145 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.8 t -59.37 153.98 17.8 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.791 0.837 . . . . 73.51 110.202 167.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 3.5 p -65.48 100.4 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.173 0 CA-C-O 121.714 0.769 . . . . 50.15 109.178 174.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -137.21 -21.01 0.55 Allowed Glycine 0 C--N 1.344 0.981 0 CA-C-N 114.87 -1.059 . . . . 51.42 111.961 -178.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.9 t -69.45 129.66 40.33 Favored 'General case' 0 C--N 1.349 0.554 0 N-CA-C 109.536 -0.542 . . . . 63.24 109.536 176.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 68.5 tp -60.28 -38.56 83.97 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.724 0.81 . . . . 53.51 110.995 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -77.44 4.97 9.73 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.515 0.726 . . . . 63.35 112.362 -174.606 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -45.7 107.41 0.1 Allowed 'General case' 0 C--N 1.366 1.32 0 C-N-CA 124.097 0.959 . . . . 74.1 111.156 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 32.3 m-70 -65.51 142.91 57.97 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-N 114.745 -1.116 . . . . 61.11 109.266 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 31.2 m-70 -63.23 95.76 0.09 Allowed 'General case' 0 N--CA 1.476 0.855 0 O-C-N 123.856 0.722 . . . . 74.34 110.058 -174.03 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 77.8 t60 -167.05 125.28 1.32 Allowed 'General case' 0 C--O 1.24 0.601 0 C-N-CA 125.213 1.405 . . . . 72.15 107.811 -174.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -93.81 143.59 26.19 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 123.701 0.801 . . . . 73.22 109.061 176.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 42.1 t-80 . . . . . 0 C--O 1.254 1.33 0 N-CA-C 108.8 -0.815 . . . . 72.04 108.8 173.897 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.3 mtm . . . . . 0 N--CA 1.484 1.236 0 N-CA-C 108.618 -0.882 . . . . 74.34 108.618 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -57.6 -47.5 21.23 Favored 'Trans proline' 0 C--N 1.387 2.575 0 C-N-CA 123.63 2.887 . . . . 70.11 112.914 -176.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.4 m -85.12 102.37 13.21 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 108.466 -0.939 . . . . 62.41 108.466 175.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.14 -19.67 61.74 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 122.766 0.426 . . . . 71.13 110.933 175.39 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -54.58 -26.34 31.81 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 124.324 1.049 . . . . 53.1 112.641 167.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -57.58 -37.78 73.76 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 123.75 0.656 . . . . 54.24 110.802 174.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -64.22 -40.96 97.14 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 116.196 -0.456 . . . . 73.33 111.097 177.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.554 ' HG3' HG11 ' A' ' 33' ' ' VAL . 1.0 OUTLIER -62.49 -42.41 99.48 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 123.713 0.633 . . . . 63.3 110.016 177.755 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 41.8 ttt180 -56.77 -44.31 81.7 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.776 0.831 . . . . 74.33 111.131 177.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.524 ' O ' HG23 ' A' ' 14' ' ' VAL . 52.5 mt-30 -68.92 -45.97 69.49 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 114.929 -1.032 . . . . 72.12 110.945 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.61 HG21 HD12 ' A' ' 40' ' ' ILE . 55.1 t -70.84 -43.47 76.96 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 124.065 0.946 . . . . 74.34 112.243 -173.44 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -61.66 -36.05 79.72 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.171 0.588 . . . . 71.34 110.168 176.311 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.508 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 60.9 tt0 -64.22 -52.51 58.47 Favored 'General case' 0 C--N 1.354 0.764 0 O-C-N 124.088 0.867 . . . . 74.41 110.21 176.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.525 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 84.9 t -55.25 -44.43 75.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 123.137 0.575 . . . . 63.54 110.22 178.057 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.01 -47.91 75.79 Favored 'General case' 0 C--O 1.248 1.017 0 C-N-CA 124.664 1.186 . . . . 52.31 112.52 -176.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.415 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 14.8 ptmm? -68.1 -35.8 78.74 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 115.564 -0.744 . . . . 71.31 110.854 -175.878 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 38.9 mm-40 -62.5 -40.09 95.58 Favored 'General case' 0 C--N 1.353 0.727 0 O-C-N 123.772 0.67 . . . . 74.14 111.25 179.191 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.525 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 13.9 mmmm -64.45 -40.14 95.16 Favored 'General case' 0 CA--C 1.551 1.008 0 O-C-N 123.425 0.453 . . . . 74.1 110.85 178.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 81.9 mt -71.74 -29.47 64.56 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.98 0.912 . . . . 71.25 112.42 177.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 90.4 mt -73.63 -33.72 64.67 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.44 0.696 . . . . 73.51 110.256 175.592 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 50.0 mt-10 -66.63 -31.75 72.63 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.527 0.731 . . . . 64.02 110.776 173.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -77.56 -41.14 40.03 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.324 0.65 . . . . 65.1 111.587 176.229 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.0 t -144.7 88.78 6.92 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 122.788 0.435 . . . . 75.44 110.085 -176.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -75.46 -15.93 19.48 Favored 'Trans proline' 0 C--N 1.38 2.202 0 C-N-CA 123.393 2.729 . . . . 54.23 113.153 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -81.79 -13.86 57.16 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.39 0.676 . . . . 72.01 110.601 174.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 67.2 m -98.11 137.56 36.7 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.241 0.617 . . . . 51.24 110.521 176.222 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -84.72 117.17 23.65 Favored 'General case' 0 C--O 1.243 0.724 0 N-CA-C 107.808 -1.182 . . . . 74.44 107.808 166.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 66.5 t -99.21 112.43 31.39 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 O-C-N 123.501 0.501 . . . . 74.14 109.876 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -97.62 178.01 5.31 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.01 0.924 . . . . 74.32 108.897 174.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.2 p -105.99 125.52 61.52 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 N-CA-C 109.624 -0.51 . . . . 74.01 109.624 173.102 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.8 tpt180 -83.08 -59.03 2.61 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 109.281 -0.636 . . . . 55.33 109.281 178.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 21.5 mtm180 -146.14 166.31 26.54 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.466 1.106 . . . . 74.14 109.74 176.735 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.554 HG11 ' HG3' ' A' ' 8' ' ' LYS . 60.9 t -130.02 111.59 21.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 N-CA-C 107.401 -1.333 . . . . 43.5 107.401 176.006 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 24.8 tp60 -107.41 109.93 21.77 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 118.008 0.367 . . . . 72.01 110.185 -177.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -78.29 137.14 37.93 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 108.626 -0.879 . . . . 65.32 108.626 170.231 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -143.55 82.65 1.74 Allowed 'General case' 0 C--O 1.242 0.662 0 N-CA-C 108.593 -0.892 . . . . 63.13 108.593 -177.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.54 -79.11 0.82 Allowed Glycine 0 C--N 1.348 1.242 0 CA-C-N 115.443 -0.799 . . . . 45.22 112.565 -178.197 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -131.98 -18.38 2.67 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.108 0.963 . . . . 72.01 110.994 174.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.511 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 7.0 m -85.21 116.74 23.74 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 122.78 0.432 . . . . 75.1 109.889 177.605 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.61 HD12 HG21 ' A' ' 11' ' ' VAL . 32.4 mt -91.0 106.35 17.44 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 N-CA-C 108.988 -0.745 . . . . 61.13 108.988 169.665 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 35.2 mtp180 -89.06 94.46 9.95 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 108.11 -1.07 . . . . 74.22 108.11 175.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.3 t -85.97 114.52 25.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 N-CA-C 108.971 -0.752 . . . . 72.31 108.971 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -84.12 109.63 17.86 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 108.024 -1.102 . . . . 73.24 108.024 172.231 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.5 mp -104.04 169.08 8.71 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 122.974 0.509 . . . . 50.13 110.286 177.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 57.8 tt0 -121.2 105.29 10.44 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.174 0.989 . . . . 75.44 109.151 -175.196 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.2 tt -101.09 110.79 22.85 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 108.102 -1.073 . . . . 74.24 108.102 -177.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 72.4 mtt180 -103.47 101.12 11.0 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.756 0.423 . . . . 74.53 110.806 -175.069 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 89.8 m -90.44 99.92 12.86 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.664 0.786 . . . . 62.12 110.84 176.114 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 18.9 m120 57.86 37.89 27.02 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 124.555 1.142 . . . . 71.12 112.027 175.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.15 -17.28 58.88 Favored Glycine 0 C--N 1.351 1.385 0 CA-C-N 115.344 -0.844 . . . . 75.35 113.314 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -81.26 123.88 28.86 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 117.602 0.701 . . . . 75.12 110.939 176.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -92.42 125.25 36.99 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.233 1.013 . . . . 64.44 110.057 -177.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -139.77 118.73 12.56 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 108.483 -0.932 . . . . 55.54 108.483 175.664 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -88.57 138.45 31.42 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 122.791 0.436 . . . . 73.31 111.355 -175.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -123.8 119.41 29.63 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.565 0.746 . . . . 75.43 109.209 178.312 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 28.2 m -86.42 100.13 12.13 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 109.391 -0.596 . . . . 74.1 109.391 175.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.467 HG22 HG23 ' A' ' 71' ' ' ILE . 45.9 t -93.31 104.21 15.49 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 N-CA-C 107.48 -1.304 . . . . 71.0 107.48 179.411 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -84.74 101.72 12.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.717 -1.129 . . . . 73.2 108.864 -176.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.538 ' HB ' HG13 ' A' ' 11' ' ' VAL . 21.6 t -106.65 111.26 34.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 124.067 0.947 . . . . 63.23 108.517 177.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.511 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 33.8 tt0 -100.97 150.13 23.2 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.523 0.729 . . . . 55.12 110.54 -175.165 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -68.16 106.28 2.36 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.355 0.662 . . . . 65.33 109.653 174.272 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 56.0 tp60 -92.83 85.96 5.35 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 108.43 -0.952 . . . . 73.35 108.43 173.142 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.02 -98.47 0.56 Allowed Glycine 0 C--N 1.348 1.244 0 N-CA-C 111.335 -0.706 . . . . 55.34 111.335 -174.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -101.53 -34.69 9.44 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.076 0.95 . . . . 72.04 109.98 176.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 65.0 p -84.87 175.97 8.78 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.827 0.851 . . . . 75.13 111.956 -174.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -114.05 139.39 49.33 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.565 1.146 . . . . 71.54 109.895 176.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 8.8 t -133.27 132.53 41.52 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.623 0.769 . . . . 73.44 110.109 -179.082 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.432 HG22 HG22 ' A' ' 59' ' ' VAL . 88.8 t -74.77 106.83 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 108.823 -0.806 . . . . 72.54 108.823 173.311 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 2.9 mmmp? -63.46 -52.03 63.16 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.689 1.196 . . . . 73.33 109.857 175.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 19.1 tpt180 -175.67 144.43 0.65 Allowed 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.105 -0.952 . . . . 75.11 109.675 178.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.467 HG23 HG22 ' A' ' 57' ' ' VAL . 35.6 mt -88.38 110.56 21.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 N-CA-C 108.194 -1.039 . . . . 53.45 108.194 168.32 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 30.7 m -91.96 106.98 18.88 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.99 -0.745 . . . . 75.3 108.99 177.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 52.6 ttt180 -68.82 129.44 39.95 Favored 'General case' 0 C--O 1.244 0.816 0 N-CA-C 108.23 -1.026 . . . . 70.21 108.23 169.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 15.3 t -60.51 131.42 50.69 Favored 'General case' 0 C--O 1.246 0.889 0 O-C-N 123.774 0.671 . . . . 62.33 110.857 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 5.4 p -73.92 102.92 2.04 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.15 0 N-CA-C 108.917 -0.772 . . . . 74.05 108.917 175.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -145.57 3.31 1.16 Allowed Glycine 0 N--CA 1.479 1.515 0 CA-C-N 115.204 -0.907 . . . . 61.3 112.453 175.17 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 47.7 t -129.02 134.09 47.99 Favored 'General case' 0 C--O 1.244 0.771 0 C-N-CA 124.577 1.151 . . . . 64.22 108.369 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -77.19 104.13 7.51 Favored 'General case' 0 C--O 1.243 0.726 0 N-CA-C 108.408 -0.96 . . . . 75.32 108.408 178.283 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -69.61 90.63 0.57 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.952 0.901 . . . . 72.43 110.142 -177.521 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 -54.2 112.08 0.9 Allowed 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 113.985 -1.462 . . . . 70.41 111.215 178.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 9.7 p80 -126.34 134.69 51.02 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.707 0.803 . . . . 74.4 109.657 -175.072 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 11.0 p80 -144.89 162.35 37.07 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 122.939 0.495 . . . . 51.41 110.709 -173.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 61.7 m-70 -100.5 173.23 6.66 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.061 0.944 . . . . 74.34 108.602 171.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -87.42 -96.33 0.09 Allowed 'General case' 0 CA--C 1.554 1.124 0 CA-C-O 118.246 -0.883 . . . . 73.5 110.006 175.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 20.8 m80 . . . . . 0 N--CA 1.494 1.762 0 N-CA-C 108.641 -0.874 . . . . 73.01 108.641 174.331 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.481 1.088 0 CA-C-O 119.03 -0.509 . . . . 72.21 109.93 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.83 90.8 0.04 OUTLIER 'Trans proline' 0 C--N 1.382 2.319 0 C-N-CA 123.047 2.498 . . . . 75.53 112.431 171.508 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.46 ' O ' ' HG3' ' A' ' 7' ' ' GLU . 35.1 p -126.36 -51.25 1.51 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.029 1.332 . . . . 55.31 109.542 -177.215 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.06 -36.69 77.89 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.045 1.338 . . . . 70.43 112.388 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -83.97 -34.72 24.33 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 122.64 0.376 . . . . 54.45 110.682 176.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -61.87 -29.41 70.17 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.681 0.792 . . . . 73.3 111.209 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 3' ' ' SER . 52.0 mt-10 -48.11 -53.57 16.17 Favored 'General case' 0 C--N 1.363 1.179 0 C-N-CA 124.074 0.949 . . . . 63.45 110.127 173.908 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.527 ' HG3' HG11 ' A' ' 33' ' ' VAL . 0.4 OUTLIER -56.22 -45.09 80.06 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 124.905 1.378 . . . . 74.51 109.732 -175.898 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -62.89 -38.12 89.63 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.97 0.908 . . . . 75.02 111.356 -177.27 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -75.02 -44.58 47.17 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.698 0.799 . . . . 55.01 110.9 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.441 HG11 ' HB ' ' A' ' 40' ' ' ILE . 90.6 t -76.41 -32.76 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.179 0.992 . . . . 63.14 112.301 -169.166 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.409 ' HG3' ' O ' ' A' ' 8' ' ' LYS . 9.1 mtmp? -61.32 -37.92 85.0 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 109.685 -0.487 . . . . 74.45 109.685 173.009 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.535 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 57.5 tt0 -67.54 -52.08 43.16 Favored 'General case' 0 C--N 1.352 0.717 0 O-C-N 124.248 0.968 . . . . 71.34 110.123 176.025 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.463 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 72.2 t -54.97 -39.88 51.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 123.223 0.609 . . . . 73.14 110.62 179.736 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.426 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -66.62 -48.42 69.55 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 115.363 -0.835 . . . . 74.11 112.078 -178.79 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -71.34 -34.9 70.94 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 123.713 0.633 . . . . 72.23 111.769 -174.263 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.535 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 20.7 mm-40 -61.63 -43.4 98.92 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 123.404 0.44 . . . . 62.32 110.623 -179.303 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.573 ' HG3' HG21 ' A' ' 68' ' ' VAL . 2.2 mmmp? -64.18 -42.79 96.55 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 123.759 0.662 . . . . 73.42 110.011 178.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.499 ' HB3' HD12 ' A' ' 46' ' ' LEU . 40.5 mt -63.0 -34.89 78.52 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.76 0.824 . . . . 75.32 112.563 177.515 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 85.1 mt -77.21 -26.41 52.7 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.389 0.676 . . . . 74.21 111.62 -177.01 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 12.5 mm-40 -69.87 -36.62 75.63 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 109.909 -0.404 . . . . 74.4 109.909 171.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -77.28 -31.37 54.77 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.312 1.045 . . . . 71.02 111.462 178.265 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.9 m -146.28 83.15 8.61 Favored Pre-proline 0 CA--C 1.56 1.35 0 C-N-CA 123.705 0.802 . . . . 72.14 109.935 -174.494 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -75.71 -21.26 14.75 Favored 'Trans proline' 0 C--N 1.375 1.951 0 C-N-CA 123.138 2.558 . . . . 64.41 112.127 177.249 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -86.57 15.28 5.71 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.326 1.05 . . . . 53.4 111.18 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 46.9 t -120.2 152.78 37.21 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.476 0.711 . . . . 62.11 111.207 -176.528 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.89 108.96 20.73 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 107.73 -1.211 . . . . 75.02 107.73 174.339 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.3 t -97.46 116.83 40.92 Favored 'Isoleucine or valine' 0 C--O 1.239 0.552 0 C-N-CA 123.508 0.723 . . . . 71.01 110.061 -176.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -101.59 161.94 13.27 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.578 1.151 . . . . 74.22 108.345 171.501 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 59.2 t -87.48 113.85 25.48 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 N-CA-C 107.834 -1.173 . . . . 51.42 107.834 169.501 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -81.89 -45.27 15.7 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.397 0.679 . . . . 63.4 110.111 -176.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 29.8 tpt180 -167.66 157.01 10.01 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 124.03 0.932 . . . . 65.14 109.145 177.53 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.527 HG11 ' HG3' ' A' ' 8' ' ' LYS . 58.0 t -120.87 130.58 74.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 123.464 0.706 . . . . 74.04 109.374 176.256 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 84.2 mm-40 -119.62 112.18 19.0 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.728 0.811 . . . . 75.13 109.706 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.549 ' HG2' HG12 ' A' ' 40' ' ' ILE . 3.6 tmtp? -92.06 107.4 19.18 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 106.747 -1.575 . . . . 74.01 106.747 173.853 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -119.55 101.58 8.03 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 108.522 -0.918 . . . . 75.5 108.522 -174.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.19 -93.72 0.52 Allowed Glycine 0 C--N 1.348 1.242 0 O-C-N 123.585 0.553 . . . . 40.33 112.488 -176.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -135.55 5.86 3.2 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.343 1.057 . . . . 64.03 109.26 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 69.3 m -118.67 116.16 26.01 Favored 'General case' 0 C--O 1.241 0.628 0 C-N-CA 124.69 1.196 . . . . 74.13 109.621 -177.585 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.549 HG12 ' HG2' ' A' ' 35' ' ' LYS . 35.0 mt -88.8 108.14 18.59 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-O 121.037 0.446 . . . . 75.01 110.119 178.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -86.17 95.22 9.5 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.403 1.081 . . . . 74.23 108.172 174.375 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 25.9 t -85.46 122.92 38.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 N-CA-C 109.13 -0.692 . . . . 61.33 109.13 178.479 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -87.24 121.21 29.39 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 108.007 -1.109 . . . . 75.13 108.007 170.41 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.8 mp -120.08 151.2 39.39 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-O 121.122 0.486 . . . . 73.12 109.917 179.289 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.507 ' HG3' ' HG3' ' A' ' 52' ' ' LYS . 39.3 tt0 -106.31 102.5 11.9 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 107.77 -1.196 . . . . 42.14 107.77 -179.648 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.499 HD12 ' HB3' ' A' ' 19' ' ' LEU . 8.8 tt -102.0 112.16 24.7 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.146 -1.057 . . . . 73.5 108.146 -174.558 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.4 ' HA ' ' O ' ' A' ' 51' ' ' LYS . 98.7 mtt180 -100.78 101.1 11.88 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.273 0.629 . . . . 72.32 110.181 -169.513 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 37.5 m -110.11 96.31 6.15 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 122.828 0.451 . . . . 71.31 110.314 179.203 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 51.8 m-20 60.14 39.12 19.86 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.699 1.2 . . . . 71.31 111.547 173.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.77 -6.52 60.53 Favored Glycine 0 C--N 1.347 1.192 0 CA-C-N 115.648 -0.705 . . . . 75.1 113.336 177.524 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.4 ' O ' ' HA ' ' A' ' 47' ' ' ARG . 27.4 mtpp -85.78 130.94 34.42 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.381 0.672 . . . . 62.32 110.315 177.508 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.507 ' HG3' ' HG3' ' A' ' 45' ' ' GLU . 39.8 ttmt -99.48 98.38 9.29 Favored 'General case' 0 C--O 1.245 0.838 0 N-CA-C 108.259 -1.015 . . . . 72.21 108.259 173.096 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -102.37 112.53 25.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.975 -1.011 . . . . 73.24 108.451 179.549 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -92.0 115.2 27.86 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 109.058 -0.719 . . . . 63.1 109.058 -177.038 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -108.45 121.1 44.25 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.627 0.771 . . . . 55.11 109.359 179.321 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 35.0 m -90.93 100.83 13.62 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 108.265 -1.013 . . . . 73.23 108.265 169.819 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.448 HG13 HG12 ' A' ' 71' ' ' ILE . 47.3 t -93.66 103.41 14.66 Favored 'Isoleucine or valine' 0 C--O 1.241 0.656 0 N-CA-C 107.326 -1.361 . . . . 75.25 107.326 177.369 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -87.59 100.8 13.06 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.439 -0.8 . . . . 73.23 108.871 -176.689 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.446 HG22 HG22 ' A' ' 68' ' ' VAL . 25.5 t -104.45 116.1 47.62 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 124.113 0.965 . . . . 63.11 109.165 -177.511 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -100.78 143.53 30.83 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.246 1.018 . . . . 63.51 109.947 -175.652 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.7 tpp180 -71.36 134.19 46.52 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.163 0.585 . . . . 62.42 110.602 176.309 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -133.05 89.84 2.67 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 108.274 -1.01 . . . . 61.12 108.274 172.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 68.26 -111.26 3.89 Favored Glycine 0 C--N 1.35 1.323 0 CA-C-N 114.813 -1.085 . . . . 73.34 112.325 -177.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -92.26 -25.68 18.5 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.287 0.635 . . . . 74.11 111.089 178.831 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 22.9 p -99.12 175.76 5.79 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.917 0.887 . . . . 75.22 111.847 -175.374 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -123.57 158.52 31.22 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.522 1.129 . . . . 62.35 109.761 179.312 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 9.0 t -145.46 135.3 23.55 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.494 0.318 . . . . 72.2 110.725 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.573 HG21 ' HG3' ' A' ' 18' ' ' LYS . 91.3 t -77.86 115.47 19.89 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 N-CA-C 109.227 -0.657 . . . . 44.43 109.227 173.888 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -80.92 -41.89 22.24 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 123.24 0.616 . . . . 75.22 110.632 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -165.38 144.35 6.42 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 123.462 0.705 . . . . 73.35 110.261 175.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.448 HG12 HG13 ' A' ' 57' ' ' VAL . 41.8 mt -104.25 107.66 22.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 N-CA-C 108.027 -1.101 . . . . 63.03 108.027 168.322 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.0 m -107.76 108.39 19.58 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.204 0.602 . . . . 74.14 109.676 -178.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 -79.29 150.01 31.63 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 109.579 -0.526 . . . . 74.12 109.579 172.518 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.3 t -65.74 115.58 6.03 Favored 'General case' 0 CA--C 1.554 1.12 0 CA-C-N 115.656 -0.702 . . . . 63.13 109.951 172.544 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 5.3 p -88.77 103.52 13.95 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 CA-C-O 121.427 0.632 . . . . 73.22 109.828 -178.834 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -96.3 -33.25 6.32 Favored Glycine 0 C--N 1.348 1.213 0 N-CA-C 111.39 -0.684 . . . . 50.13 111.39 174.173 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 24.7 p -99.69 115.29 29.12 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.687 0.795 . . . . 60.21 110.198 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.2 pp -82.91 178.31 8.23 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-O 121.414 0.626 . . . . 71.21 111.04 174.562 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -136.0 -166.51 1.88 Allowed 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.109 0.964 . . . . 72.23 109.038 -179.603 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 82.2 m-70 -73.45 104.37 4.42 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 122.724 0.409 . . . . 50.33 110.338 -179.07 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 57.0 p-80 -87.65 124.79 33.91 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 107.916 -1.142 . . . . 75.34 107.916 169.31 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -76.45 -31.73 58.0 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.11 0.564 . . . . 75.35 111.056 -173.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -136.27 168.58 19.15 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.994 0.917 . . . . 73.24 110.638 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 30.0 m170 -92.43 42.24 1.1 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 124.215 1.006 . . . . 71.2 110.255 -178.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 29.3 m-70 . . . . . 0 C--O 1.249 1.029 0 C-N-CA 123.51 0.724 . . . . 71.22 109.05 -178.571 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.5 ptt? . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 109.69 -0.485 . . . . 72.22 109.69 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -63.2 -51.21 2.89 Favored 'Trans proline' 0 C--N 1.373 1.862 0 C-N-CA 122.029 1.819 . . . . 73.23 110.351 167.31 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 37.2 t -159.78 145.63 15.76 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 107.474 -1.306 . . . . 73.42 107.474 173.75 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.32 -32.22 72.2 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 123.027 0.531 . . . . 74.13 111.102 -174.292 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -76.02 -32.96 59.64 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.002 0.921 . . . . 74.25 110.487 178.082 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -63.25 -32.29 73.66 Favored 'General case' 0 C--N 1.353 0.746 0 C-N-CA 124.111 0.964 . . . . 74.4 110.085 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.555 ' O ' HG23 ' A' ' 11' ' ' VAL . 39.9 mm-40 -55.04 -45.91 75.26 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 124.258 0.974 . . . . 74.24 111.895 175.82 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -62.2 -36.57 82.33 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 122.898 0.479 . . . . 74.01 111.389 -178.464 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.405 ' HA ' ' HE3' ' A' ' 12' ' ' LYS . 43.5 mtp180 -63.73 -38.96 93.05 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 115.557 -0.747 . . . . 74.44 109.797 179.172 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.5 mt-30 -66.59 -40.93 89.13 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 114.753 -1.112 . . . . 73.12 110.875 176.342 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 7' ' ' GLU . 63.0 t -61.05 -44.78 98.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 123.434 0.694 . . . . 71.54 111.9 -175.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.405 ' HE3' ' HA ' ' A' ' 9' ' ' ARG . 10.1 mtmp? -60.92 -32.69 72.17 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 123.732 0.645 . . . . 72.45 110.724 179.65 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.511 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.9 tt0 -71.68 -53.78 12.45 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 115.361 -0.836 . . . . 70.33 110.323 176.371 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.402 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 98.5 t -53.91 -36.27 30.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 C-N-CA 123.598 0.759 . . . . 72.34 110.759 179.387 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.466 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -66.85 -50.95 60.9 Favored 'General case' 0 C--O 1.247 0.924 0 CA-C-N 114.795 -1.093 . . . . 43.25 111.454 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.45 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 20.5 ptmt -69.46 -33.08 72.38 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 116.18 -0.464 . . . . 73.23 111.925 -175.133 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.511 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 19.3 mm-40 -61.86 -43.0 99.72 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 123.691 0.619 . . . . 72.45 110.122 -179.114 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.432 ' HG3' HG21 ' A' ' 68' ' ' VAL . 14.9 mmmm -73.88 -22.43 59.73 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 115.603 -0.726 . . . . 62.15 111.143 -178.748 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 57.9 mt -73.9 -36.22 64.73 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 122.852 0.461 . . . . 65.34 111.541 169.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 83.6 mt -66.12 -32.15 73.44 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.627 0.771 . . . . 63.45 110.77 178.445 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -57.19 -41.31 79.08 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.918 0.887 . . . . 71.33 110.962 174.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -80.75 -51.72 8.34 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.488 -0.778 . . . . 73.2 110.824 -177.003 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 27.1 t -131.11 89.4 42.14 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 123.277 0.631 . . . . 64.13 109.927 -175.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -80.06 -1.93 11.73 Favored 'Trans proline' 0 C--N 1.375 1.965 0 C-N-CA 122.989 2.459 . . . . 73.41 112.592 174.448 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -86.56 6.55 30.19 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.964 0.906 . . . . 75.31 111.832 -178.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 21.5 p -143.72 141.98 30.73 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.514 0.726 . . . . 65.22 110.644 -171.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -86.72 136.63 32.94 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 108.342 -0.985 . . . . 72.53 108.342 174.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.508 HG22 HD12 ' A' ' 46' ' ' LEU . 40.7 t -98.61 117.18 43.21 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 C-N-CA 123.114 0.566 . . . . 73.45 110.236 -174.069 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 54.4 tp60 -91.71 147.57 22.9 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.806 1.243 . . . . 75.21 109.168 175.363 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 79.9 t -87.92 121.2 38.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 N-CA-C 108.343 -0.984 . . . . 61.54 108.343 170.279 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.3 tpt180 -94.72 -59.62 1.88 Allowed 'General case' 0 N--CA 1.477 0.88 0 O-C-N 123.295 0.372 . . . . 74.31 110.242 -178.111 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 50.3 mtt180 -148.53 165.2 31.93 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 124.321 1.048 . . . . 73.43 110.166 -179.622 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 82.0 t -137.16 132.78 46.87 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 C-N-CA 124.346 1.059 . . . . 73.24 109.127 178.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.414 ' HB2' ' HB2' ' A' ' 41' ' ' ARG . 69.2 mm-40 -125.46 108.57 11.76 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.332 1.053 . . . . 73.5 108.814 -177.213 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.5 tmtt? -92.87 106.92 18.81 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 108.042 -1.096 . . . . 70.2 108.042 -176.636 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.2 mm-40 -120.51 89.01 3.04 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.443 0.697 . . . . 73.33 109.791 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.6 -98.58 0.41 Allowed Glycine 0 C--N 1.35 1.339 0 CA-C-N 115.598 -0.728 . . . . 72.33 112.501 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -105.87 -26.16 11.84 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.738 0.815 . . . . 70.12 110.349 175.125 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 25.1 m -87.77 98.68 11.59 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.406 0.683 . . . . 74.31 110.475 -177.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.523 HD12 HG21 ' A' ' 11' ' ' VAL . 40.1 mt -90.12 108.47 19.51 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 CA-C-N 116.085 -0.507 . . . . 72.35 109.867 171.692 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.584 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 91.6 mtt180 -84.12 105.8 15.27 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.402 1.081 . . . . 65.04 109.388 174.44 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.1 t -95.19 118.94 42.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 N-CA-C 108.721 -0.844 . . . . 54.24 108.721 174.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -83.74 115.24 22.11 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 107.992 -1.114 . . . . 75.13 107.992 168.271 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.445 HD11 ' HB1' ' A' ' 15' ' ' ALA . 2.7 mp -108.71 170.83 7.78 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.887 -0.783 . . . . 53.5 108.887 174.355 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -135.75 107.68 7.11 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.862 -0.792 . . . . 74.52 108.862 -168.305 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.508 HD12 HG22 ' A' ' 28' ' ' VAL . 9.2 tt -127.71 138.15 52.69 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.831 1.252 . . . . 75.44 108.697 -168.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 48.9 mtm105 -102.42 99.83 9.92 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 122.828 0.451 . . . . 72.04 110.923 -175.421 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 1.9 m -98.5 116.89 31.69 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.795 0.838 . . . . 51.45 110.225 -179.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 61.93 30.42 18.08 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 124.324 1.05 . . . . 72.22 112.498 174.316 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 84.45 5.91 86.47 Favored Glycine 0 C--N 1.343 0.964 0 CA-C-N 116.131 -0.486 . . . . 54.22 113.092 -178.652 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.532 ' HA ' ' HE2' ' A' ' 51' ' ' LYS . 9.9 mmpt? -110.97 127.16 55.41 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.629 0.772 . . . . 52.14 109.813 175.851 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -79.61 113.57 17.86 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 108.209 -1.034 . . . . 53.44 108.209 176.418 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -120.51 127.82 52.54 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.773 1.229 . . . . 74.22 109.091 178.385 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -88.58 130.02 35.35 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 109.163 -0.681 . . . . 73.33 109.163 175.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -114.22 118.71 34.74 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 109.279 -0.637 . . . . 72.45 109.279 178.295 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 38.4 m -86.16 100.7 12.4 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 108.458 -0.942 . . . . 75.42 108.458 172.367 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.466 HG11 ' HA ' ' A' ' 15' ' ' ALA . 60.1 t -92.91 106.52 18.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 N-CA-C 108.411 -0.959 . . . . 72.45 108.411 178.713 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.584 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 33.1 mt-10 -77.31 107.6 9.83 Favored 'General case' 0 C--O 1.222 -0.353 0 N-CA-C 108.056 -1.09 . . . . 63.51 108.056 178.213 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.521 HG22 HG22 ' A' ' 68' ' ' VAL . 38.8 t -112.14 124.38 68.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 N-CA-C 109.006 -0.739 . . . . 72.42 109.006 176.894 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -112.92 147.51 36.92 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.499 0.719 . . . . 72.24 110.128 -177.421 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -74.96 106.78 6.63 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.372 -0.831 . . . . 75.23 110.357 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 22.7 tp60 -91.22 79.12 5.73 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 108.388 -0.968 . . . . 75.0 108.388 174.32 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 73.24 -100.53 1.05 Allowed Glycine 0 C--N 1.348 1.215 0 CA-C-N 114.986 -1.006 . . . . 74.33 112.366 -179.615 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -95.0 -32.2 13.26 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.142 0.977 . . . . 52.12 110.265 176.255 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.8 p -96.08 176.46 6.08 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.687 0.795 . . . . 63.11 111.358 -175.329 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' TRP . . . . . 0.427 ' HZ2' ' HB3' ' A' ' 7' ' ' GLU . 96.3 m95 -119.08 149.07 42.3 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.844 1.258 . . . . 72.5 109.934 179.21 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 14.9 t -147.92 140.19 24.31 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.276 0.63 . . . . 65.32 110.281 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.521 HG22 HG22 ' A' ' 59' ' ' VAL . 76.4 t -80.78 114.15 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 123.047 0.539 . . . . 72.24 110.815 -177.503 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -65.41 -54.75 24.18 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.743 1.217 . . . . 74.41 110.85 175.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 2.3 tpm_? -163.36 132.18 3.92 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.608 -0.723 . . . . 74.23 110.012 -178.26 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.413 HG12 HG13 ' A' ' 57' ' ' VAL . 63.5 mt -87.76 107.4 17.29 Favored 'Isoleucine or valine' 0 C--O 1.24 0.568 0 N-CA-C 107.828 -1.175 . . . . 64.54 107.828 167.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 22.2 m -98.48 115.5 28.68 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.112 -0.949 . . . . 74.43 108.773 -178.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 11.8 ttm180 -69.49 149.31 48.4 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 108.883 -0.784 . . . . 75.31 108.883 171.61 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 8.1 t -59.94 152.82 22.65 Favored 'General case' 0 C--O 1.245 0.867 0 C-N-CA 123.0 0.52 . . . . 73.44 110.307 173.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 7.6 p -61.85 123.9 15.4 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 N-CA-C 109.441 -0.577 . . . . 75.43 109.441 176.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 165.34 -92.38 0.11 Allowed Glycine 0 C--N 1.333 0.385 0 N-CA-C 110.202 -1.159 . . . . 72.23 110.202 -175.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 36.6 t -81.38 80.07 7.86 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 108.976 -0.75 . . . . 64.23 108.976 176.578 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 68.0 tp -90.43 136.18 33.22 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.387 -0.824 . . . . 65.01 109.444 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -65.75 129.93 41.49 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 123.926 0.766 . . . . 71.32 109.69 174.084 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 11.5 p80 -82.53 61.69 5.8 Favored 'General case' 0 N--CA 1.482 1.125 0 CA-C-O 122.167 0.984 . . . . 73.44 110.343 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 26.3 p80 -67.35 134.12 50.91 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 114.616 -1.175 . . . . 53.11 111.279 -173.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 33.9 t60 -129.17 117.31 20.58 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.909 0.884 . . . . 72.31 109.032 178.124 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 50.7 m-70 -131.19 134.63 46.68 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 108.513 -0.921 . . . . 63.14 108.513 178.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 8.9 p80 -61.1 140.75 57.8 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.6 0.76 . . . . 72.23 111.558 -173.523 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 10.4 p-80 . . . . . 0 CA--C 1.552 1.055 0 CA-C-O 118.916 -0.564 . . . . 71.44 109.891 173.296 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.8 mmt . . . . . 0 N--CA 1.484 1.273 0 N-CA-C 110.233 -0.284 . . . . 71.51 110.233 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -76.39 72.6 5.41 Favored 'Trans proline' 0 C--N 1.37 1.708 0 C-N-CA 122.15 1.9 . . . . 54.31 110.324 175.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.1 t -62.38 -28.0 69.47 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.968 0.907 . . . . 74.25 112.966 -168.544 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -66.65 -49.13 67.23 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.938 0.495 . . . . 73.12 110.13 172.529 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -75.63 -19.29 59.31 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.847 1.259 . . . . 50.43 111.251 -179.573 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -64.18 -14.31 54.37 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.372 1.069 . . . . 64.4 111.822 -174.232 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -46.28 -53.23 11.11 Favored 'General case' 0 C--O 1.209 -1.037 0 C-N-CA 123.764 0.825 . . . . 74.52 109.948 165.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.658 ' HG3' HG11 ' A' ' 33' ' ' VAL . 1.1 mptm? -58.57 -45.34 89.2 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.312 1.045 . . . . 75.14 111.208 179.478 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 28.3 mmm180 -55.97 -42.24 75.98 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.857 0.863 . . . . 74.34 110.881 -177.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -78.57 -55.13 5.44 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 114.773 -1.103 . . . . 52.34 111.34 -178.302 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.426 HG12 HG21 ' A' ' 42' ' ' VAL . 73.9 t -65.81 -37.58 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 124.842 1.257 . . . . 73.24 113.218 -166.213 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.473 ' HD2' HG21 ' A' ' 30' ' ' VAL . 22.3 mtmm -64.01 -38.12 89.92 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-N 118.163 0.438 . . . . 75.41 109.903 178.463 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.537 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.5 tt0 -69.05 -45.53 70.18 Favored 'General case' 0 C--N 1.352 0.679 0 CA-C-N 115.349 -0.841 . . . . 64.44 110.494 178.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.484 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 92.8 t -60.19 -41.51 86.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 123.228 0.611 . . . . 73.44 109.99 177.205 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.76 -39.08 76.92 Favored 'General case' 0 C--O 1.244 0.769 0 C-N-CA 124.213 1.005 . . . . 75.51 111.927 -176.545 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.454 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 21.6 ptmt -71.87 -30.89 65.9 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 119.297 -0.383 . . . . 43.54 110.566 -179.128 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 24.4 mm-40 -61.91 -41.77 98.31 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 123.609 0.568 . . . . 74.44 110.4 174.232 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.648 ' HB3' HD11 ' A' ' 71' ' ' ILE . 2.1 mmmp? -61.41 -36.54 80.6 Favored 'General case' 0 CA--C 1.55 0.948 0 O-C-N 124.048 0.842 . . . . 73.34 110.507 178.593 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.593 ' HB3' HD12 ' A' ' 46' ' ' LEU . 52.0 mt -76.07 -31.91 59.0 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.788 0.835 . . . . 73.33 112.436 177.276 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 93.3 mt -73.11 -25.44 60.86 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.987 0.515 . . . . 62.44 110.902 178.619 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 49.5 mt-10 -65.11 -42.71 93.71 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-O 121.293 0.568 . . . . 73.1 110.149 171.82 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -71.37 -36.3 71.4 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 115.044 -0.98 . . . . 71.53 111.238 178.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.2 t -148.88 89.75 4.91 Favored Pre-proline 0 CA--C 1.544 0.716 0 CA-C-N 115.836 -0.62 . . . . 71.24 109.688 -175.261 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -70.37 -17.46 34.78 Favored 'Trans proline' 0 C--N 1.377 2.034 0 C-N-CA 122.828 2.352 . . . . 61.23 111.609 172.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -79.59 -10.73 59.85 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.338 1.055 . . . . 61.43 112.099 -176.315 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 68.7 p -104.8 157.0 17.5 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.514 0.726 . . . . 72.1 111.672 -178.32 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.504 ' HA ' ' HE3' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -102.86 124.18 47.91 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 108.353 -0.98 . . . . 62.42 108.353 164.626 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.402 HG11 HD12 ' A' ' 19' ' ' LEU . 49.4 t -101.4 114.22 39.96 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 123.796 0.838 . . . . 72.54 109.958 -178.363 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -93.53 165.11 12.91 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 124.322 1.049 . . . . 74.31 108.693 171.584 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.473 HG21 ' HD2' ' A' ' 12' ' ' LYS . 4.0 p -81.92 132.5 31.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 N-CA-C 109.0 -0.741 . . . . 60.21 109.0 165.203 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.403 ' HG2' ' ND2' ' A' ' 54' ' ' ASN . 19.7 tpt180 -100.93 -44.21 5.82 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.362 0.665 . . . . 72.2 109.933 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -167.67 151.02 6.11 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 108.024 -1.102 . . . . 64.22 108.024 -175.039 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.658 HG11 ' HG3' ' A' ' 8' ' ' LYS . 65.8 t -129.62 130.77 67.11 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 123.487 0.715 . . . . 60.33 109.297 176.163 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -121.88 108.11 13.07 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.06 0.944 . . . . 70.11 109.801 177.054 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -92.17 109.68 21.05 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 108.395 -0.965 . . . . 74.34 108.395 171.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -122.52 90.13 3.24 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.768 0.827 . . . . 64.44 109.598 -178.108 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.26 -85.38 0.1 Allowed Glycine 0 C--N 1.348 1.2 0 CA-C-N 115.78 -0.645 . . . . 54.53 114.218 173.596 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -118.2 4.44 11.95 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 124.303 1.041 . . . . 64.0 111.869 -176.092 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 47.5 m -142.18 119.47 11.51 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.815 0.446 . . . . 62.15 111.043 -174.57 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.405 HD12 HG21 ' A' ' 11' ' ' VAL . 24.5 mt -94.75 108.12 20.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 123.171 0.588 . . . . 53.14 109.758 171.763 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 11.9 mtm180 -90.12 99.98 12.89 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 107.365 -1.346 . . . . 73.25 107.365 174.196 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.439 HG13 HG22 ' A' ' 33' ' ' VAL . 40.5 t -91.07 116.53 32.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 N-CA-C 108.911 -0.774 . . . . 75.35 108.911 178.228 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -79.15 127.04 31.52 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 107.652 -1.24 . . . . 74.31 107.652 167.085 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.8 mp -124.22 154.42 40.18 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 109.386 -0.598 . . . . 73.4 109.386 177.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -107.27 104.5 14.13 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 108.932 -0.766 . . . . 74.43 108.932 -177.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.593 HD12 ' HB3' ' A' ' 19' ' ' LEU . 9.5 tt -100.76 126.53 47.32 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 108.244 -1.021 . . . . 64.21 108.244 -178.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -125.58 101.57 6.97 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 122.884 0.473 . . . . 74.14 110.949 -173.672 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 16.0 m -110.44 119.05 37.93 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.15 0.58 . . . . 61.14 109.936 -177.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 61.75 24.05 14.24 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.482 1.113 . . . . 70.0 111.831 172.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.76 -14.7 61.57 Favored Glycine 0 C--N 1.353 1.5 0 CA-C-O 119.319 -0.712 . . . . 62.25 113.496 178.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.24 148.15 29.62 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 118.239 1.019 . . . . 51.11 108.621 173.336 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -118.15 134.72 54.74 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.616 0.766 . . . . 72.52 109.313 176.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -145.29 127.87 16.1 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 108.597 -0.89 . . . . 62.04 108.597 174.572 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.403 ' ND2' ' HG2' ' A' ' 31' ' ' ARG . 3.1 m-20 -86.85 143.04 27.63 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.975 0.91 . . . . 63.51 109.3 -178.529 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -132.07 120.25 22.11 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.018 0.527 . . . . 72.43 110.007 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 91.0 m -84.98 100.29 11.56 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 108.825 -0.805 . . . . 62.11 108.825 170.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 71.2 t -93.02 103.86 15.12 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 N-CA-C 107.047 -1.464 . . . . 71.24 107.047 174.6 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.434 ' HB2' ' HB2' ' A' ' 69' ' ' LYS . 41.1 mt-10 -79.41 114.58 18.46 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 114.917 -1.038 . . . . 75.34 108.583 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.4 HG22 HG22 ' A' ' 68' ' ' VAL . 44.5 t -115.73 122.2 68.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 124.047 0.939 . . . . 62.44 108.61 177.702 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.474 ' HB2' ' HD3' ' A' ' 69' ' ' LYS . 35.9 tt0 -100.59 144.68 29.28 Favored 'General case' 0 C--O 1.241 0.653 0 C-N-CA 124.426 1.09 . . . . 75.12 109.827 -173.399 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 26.0 tpt180 -80.73 105.5 12.01 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.388 0.675 . . . . 74.53 109.447 174.59 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -108.12 89.47 3.01 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.375 1.07 . . . . 73.41 108.208 179.079 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 71.0 -107.51 2.19 Favored Glycine 0 CA--C 1.529 0.965 0 N-CA-C 111.693 -0.563 . . . . 71.44 111.693 -174.302 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -113.6 -3.57 13.6 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.882 0.873 . . . . 73.43 109.99 174.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 32.8 p -99.02 172.55 7.33 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.329 0.585 . . . . 74.3 111.096 176.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -119.49 140.72 50.02 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.876 1.27 . . . . 71.04 109.227 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 9.0 t -140.28 124.32 17.54 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 121.196 0.522 . . . . 73.32 110.453 -178.284 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.4 HG22 HG22 ' A' ' 59' ' ' VAL . 90.0 t -75.28 114.36 15.24 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 C-N-CA 123.287 0.635 . . . . 65.1 110.17 -177.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.474 ' HD3' ' HB2' ' A' ' 60' ' ' GLU . 32.1 mmmt -64.93 -50.4 66.61 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.626 1.171 . . . . 52.21 110.43 176.208 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -170.37 165.1 8.8 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 124.508 1.13 . . . . 72.45 110.035 175.022 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.648 HD11 ' HB3' ' A' ' 18' ' ' LYS . 75.1 mt -101.44 107.22 20.99 Favored 'Isoleucine or valine' 0 C--O 1.24 0.593 0 N-CA-C 107.491 -1.299 . . . . 70.42 107.491 166.038 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 12.3 m -92.87 114.58 27.18 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 109.299 -0.63 . . . . 75.11 109.299 -178.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 -68.05 141.47 56.16 Favored 'General case' 0 C--O 1.245 0.816 0 N-CA-C 109.037 -0.727 . . . . 72.45 109.037 169.778 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.5 t -64.38 137.84 58.11 Favored 'General case' 0 C--O 1.245 0.845 0 N-CA-C 109.112 -0.699 . . . . 71.21 109.112 173.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.484 HG23 ' HB3' ' A' ' 78' ' ' LEU . 14.2 p -121.3 134.33 65.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 108.462 -0.94 . . . . 51.34 108.462 -176.395 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -163.36 100.86 0.18 Allowed Glycine 0 N--CA 1.466 0.646 0 N-CA-C 109.619 -1.392 . . . . 63.13 109.619 -178.285 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.1 m 61.16 22.34 12.66 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.288 1.035 . . . . 74.24 111.244 -171.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.484 ' HB3' HG23 ' A' ' 75' ' ' VAL . 6.5 tt -109.14 131.09 55.4 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 107.74 -1.207 . . . . 74.22 107.74 -176.398 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -73.2 93.86 1.9 Allowed 'General case' 0 C--O 1.24 0.571 0 O-C-N 123.651 0.594 . . . . 52.01 109.948 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.417 ' ND1' HG21 ' A' ' 75' ' ' VAL . 21.1 p-80 -74.92 83.38 2.2 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 107.717 -1.216 . . . . 63.42 107.717 170.048 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 30.0 t60 -63.79 119.53 10.15 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 114.233 -1.349 . . . . 54.23 110.285 -170.196 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 57.4 m80 -69.27 103.09 1.86 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.596 1.158 . . . . 74.11 111.179 -173.116 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 20.5 t-80 -118.9 123.98 45.98 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.061 -1.089 . . . . 74.32 108.061 174.34 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -67.58 137.04 55.39 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.204 0.602 . . . . 64.0 110.956 -173.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 9.7 p80 . . . . . 0 N--CA 1.478 0.943 0 C-N-CA 124.738 1.215 . . . . 74.13 109.128 177.772 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 46.0 ttm . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 109.99 -0.374 . . . . 75.33 109.99 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -84.35 115.26 1.91 Allowed 'Trans proline' 0 C--N 1.375 1.945 0 C-N-CA 122.472 2.115 . . . . 74.25 110.648 172.087 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 69.7 p -102.77 9.4 39.08 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.309 0.644 . . . . 55.42 111.593 -178.416 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -61.48 -52.67 63.55 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.3 1.04 . . . . 65.33 111.659 -174.331 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.456 ' HA ' ' HD3' ' A' ' 8' ' ' LYS . 17.0 tp10 -70.11 -28.42 65.38 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-N 116.128 -0.487 . . . . 63.23 110.587 -179.421 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -67.59 -28.76 68.04 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.252 1.021 . . . . 73.23 111.138 178.156 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -56.69 -44.08 81.13 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.333 0.653 . . . . 54.12 110.309 174.123 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.456 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 0.1 OUTLIER -64.67 -45.47 86.58 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 124.059 0.849 . . . . 75.03 108.977 177.592 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 21.7 mtm180 -58.25 -40.02 80.68 Favored 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 123.866 0.866 . . . . 75.54 111.649 -178.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -67.57 -55.12 14.66 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.128 0.971 . . . . 74.01 110.314 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.602 HG21 HD12 ' A' ' 40' ' ' ILE . 72.4 t -64.97 -36.31 77.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 123.811 0.844 . . . . 74.4 112.436 -172.504 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 8' ' ' LYS . 10.3 mtmp? -65.4 -42.63 92.39 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.658 0.383 . . . . 72.11 110.26 176.362 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.501 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.2 tt0 -66.09 -49.29 68.1 Favored 'General case' 0 C--N 1.352 0.691 0 O-C-N 123.866 0.729 . . . . 64.11 110.217 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.484 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 84.6 t -57.87 -46.23 87.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 123.232 0.613 . . . . 74.43 109.862 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.449 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -60.25 -51.61 68.84 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.77 0.828 . . . . 52.03 112.295 -178.305 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -63.4 -39.5 94.67 Favored 'General case' 0 C--N 1.351 0.633 0 O-C-N 123.924 0.765 . . . . 73.32 110.406 -178.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 33.4 mm-40 -66.59 -40.66 89.0 Favored 'General case' 0 C--N 1.353 0.748 0 O-C-N 123.409 0.443 . . . . 73.53 110.975 178.479 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.484 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 73.4 mmtt -64.17 -35.31 80.38 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.484 0.714 . . . . 64.43 110.95 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.614 ' HB3' HD12 ' A' ' 46' ' ' LEU . 61.5 mt -75.5 -30.44 59.85 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.627 -0.715 . . . . 75.11 111.545 175.686 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.0 mt -73.29 -28.4 62.09 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.523 0.729 . . . . 72.5 110.978 174.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 24.4 mm-40 -59.24 -36.35 75.29 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 123.29 0.636 . . . . 75.32 110.172 174.458 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -91.83 -30.4 16.22 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 114.444 -1.253 . . . . 61.44 111.199 -175.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.2 t -148.81 88.33 5.24 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 122.82 0.448 . . . . 52.14 110.685 -175.485 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -76.04 -20.91 14.46 Favored 'Trans proline' 0 C--N 1.383 2.359 0 C-N-CA 123.155 2.57 . . . . 75.42 113.367 178.42 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -78.31 -13.18 59.96 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.346 0.658 . . . . 74.11 111.733 -176.505 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 54.0 p -105.87 135.5 47.18 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.577 0.751 . . . . 33.01 110.487 177.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -75.06 126.61 31.38 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 108.708 -0.849 . . . . 55.22 108.708 167.414 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 58.6 t -100.85 112.91 35.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 109.421 -0.585 . . . . 62.04 109.421 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.512 ' HB2' ' HB3' ' A' ' 45' ' ' GLU . 15.8 mm100 -100.0 123.76 44.61 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.909 1.284 . . . . 74.32 109.397 -178.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 p -64.88 115.78 3.52 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 N-CA-C 109.121 -0.696 . . . . 51.31 109.121 173.59 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 -96.53 -42.14 8.22 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.716 -0.675 . . . . 73.05 110.25 -171.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.473 ' HB3' ' HB2' ' A' ' 43' ' ' GLU . 60.6 ttt180 -154.71 143.79 21.05 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.463 0.705 . . . . 72.11 110.181 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.8 t -114.63 110.69 32.97 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 N-CA-C 107.982 -1.118 . . . . 71.23 107.982 173.253 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 23.7 tp60 -125.7 117.07 22.69 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 118.162 0.437 . . . . 61.23 111.308 -174.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.6 tppp? -78.23 134.66 37.55 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.905 0.882 . . . . 44.03 110.59 178.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 18.9 mm100 -128.43 84.05 2.21 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.365 1.066 . . . . 73.53 108.331 170.44 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.43 -93.18 0.7 Allowed Glycine 0 C--N 1.35 1.344 0 CA-C-N 115.83 -0.623 . . . . 74.24 111.618 -175.312 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.498 ' HB3' ' HB3' ' A' ' 61' ' ' ARG . 3.9 m-20 -119.27 -13.07 9.34 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 123.557 0.743 . . . . 65.23 110.299 173.3 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.617 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 21.2 m -91.84 99.25 12.15 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 123.685 0.794 . . . . 72.04 110.177 -179.178 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.602 HD12 HG21 ' A' ' 11' ' ' VAL . 37.9 mt -76.55 107.77 8.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 N-CA-C 108.988 -0.745 . . . . 74.3 108.988 175.071 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.474 HH21 HG21 ' A' ' 56' ' ' THR . 54.0 mtp180 -83.68 95.4 8.37 Favored 'General case' 0 C--O 1.24 0.603 0 N-CA-C 107.508 -1.293 . . . . 73.22 107.508 169.133 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.419 HG21 ' HB2' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -85.02 123.31 39.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 N-CA-C 108.685 -0.857 . . . . 71.11 108.685 173.948 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.473 ' HB2' ' HB3' ' A' ' 32' ' ' ARG . 45.0 mt-10 -89.33 130.51 35.7 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 123.943 0.897 . . . . 63.23 108.748 170.367 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.2 mp -130.2 168.68 16.44 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.214 0.53 . . . . 72.24 110.108 179.137 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.512 ' HB3' ' HB2' ' A' ' 29' ' ' GLN . 31.1 tt0 -118.24 119.33 34.36 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 125.455 1.502 . . . . 72.31 108.508 -174.177 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.614 HD12 ' HB3' ' A' ' 19' ' ' LEU . 8.1 tt -133.36 129.85 38.01 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.077 -1.453 . . . . 75.14 107.077 -176.867 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 50.8 mtp180 -100.28 102.76 14.11 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.147 0.579 . . . . 73.23 109.882 -175.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.1 m -101.09 122.64 43.94 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 108.589 -0.893 . . . . 64.23 108.589 179.7 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 60.74 24.87 14.72 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 124.075 0.95 . . . . 73.44 111.789 174.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 96.17 -21.4 45.48 Favored Glycine 0 C--N 1.35 1.336 0 CA-C-N 115.902 -0.59 . . . . 44.02 113.049 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -84.56 157.24 21.3 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.044 0.938 . . . . 65.25 110.063 -179.05 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -111.97 105.95 14.51 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.281 0.632 . . . . 61.5 111.172 -173.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.551 ' HG2' ' HD2' ' A' ' 73' ' ' ARG . 13.2 mp0 -105.11 143.37 33.38 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.055 0.942 . . . . 62.32 110.299 179.7 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -93.96 131.63 39.22 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 108.949 -0.76 . . . . 74.42 108.949 173.238 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.534 ' CE2' ' HB3' ' A' ' 46' ' ' LEU . 20.9 m-85 -120.44 121.45 38.55 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.535 0.734 . . . . 74.41 109.726 178.466 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.474 HG21 HH21 ' A' ' 41' ' ' ARG . 25.1 m -87.63 103.88 15.99 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.757 0.823 . . . . 33.51 109.455 173.56 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.449 HG11 ' HA ' ' A' ' 15' ' ' ALA . 48.9 t -93.74 105.26 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 N-CA-C 107.55 -1.278 . . . . 54.45 107.55 172.621 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -88.49 100.11 12.81 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 108.407 -0.961 . . . . 64.03 108.407 -177.441 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.573 HG22 HG22 ' A' ' 68' ' ' VAL . 29.1 t -104.03 118.92 51.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 123.792 0.837 . . . . 63.52 108.948 -178.63 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.617 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 31.0 tt0 -101.07 146.47 27.4 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.089 0.956 . . . . 64.3 110.114 -177.432 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.498 ' HB3' ' HB3' ' A' ' 38' ' ' ASN . 7.7 tpp180 -74.31 142.16 45.21 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 116.158 -0.474 . . . . 71.11 110.106 173.416 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -142.61 83.3 1.81 Allowed 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 108.123 -1.066 . . . . 71.21 108.123 175.043 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.21 -104.07 1.2 Allowed Glycine 0 C--N 1.345 1.08 0 CA-C-N 115.33 -0.85 . . . . 62.44 112.032 -176.213 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -101.84 -19.18 15.41 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.123 0.569 . . . . 62.14 111.091 179.468 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.6 t -100.25 172.9 6.88 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 122.869 0.468 . . . . 74.1 111.319 -176.359 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -123.08 120.96 34.83 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.605 1.162 . . . . 72.43 109.208 179.119 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.9 t -111.97 120.5 42.12 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 123.918 0.887 . . . . 72.41 110.484 179.582 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.573 HG22 HG22 ' A' ' 59' ' ' VAL . 58.9 t -74.81 120.18 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 N-CA-C 109.68 -0.489 . . . . 70.15 109.68 179.092 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.412 ' HA ' ' HE2' ' A' ' 69' ' ' LYS . 11.5 mmpt? -76.59 -55.59 5.38 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.394 1.077 . . . . 71.21 110.923 -179.352 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 23.2 ttt85 -163.68 125.73 2.46 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.687 -0.688 . . . . 75.3 110.412 -172.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.456 HD11 ' HB3' ' A' ' 18' ' ' LYS . 57.1 mt -93.35 131.05 41.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 N-CA-C 107.917 -1.142 . . . . 73.04 107.917 167.5 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 84.7 m -137.91 125.48 22.14 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 123.516 0.726 . . . . 61.24 109.689 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.551 ' HD2' ' HG2' ' A' ' 53' ' ' GLU . 36.7 ttp85 -75.37 144.65 42.19 Favored 'General case' 0 C--O 1.242 0.701 0 N-CA-C 108.43 -0.952 . . . . 72.14 108.43 170.126 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.3 t -57.78 148.08 26.16 Favored 'General case' 0 C--O 1.249 1.073 0 C-N-CA 123.478 0.711 . . . . 73.24 109.55 172.516 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 77.4 t -63.57 98.03 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.355 0.837 0 CA-C-O 121.662 0.744 . . . . 63.11 109.213 -178.277 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -119.44 34.28 4.33 Favored Glycine 0 C--N 1.339 0.696 0 CA-C-N 114.271 -1.331 . . . . 45.44 109.778 175.338 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.1 t -147.64 -167.64 2.85 Favored 'General case' 0 C--O 1.243 0.747 0 C-N-CA 125.293 1.437 . . . . 75.42 107.431 -175.719 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.435 HD23 ' H ' ' A' ' 78' ' ' LEU . 2.5 pt? -65.19 145.85 55.72 Favored 'General case' 0 C--O 1.249 1.065 0 N-CA-C 109.647 -0.501 . . . . 73.4 109.647 171.362 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -75.92 86.02 2.86 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.298 -0.865 . . . . 75.42 109.091 178.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 8.7 p-80 -56.99 90.28 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.892 1.677 . . . . 63.35 112.804 -174.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 35.0 t-80 -86.7 121.4 29.16 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 109.309 -0.626 . . . . 74.21 109.309 173.366 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 7.3 p80 -119.75 162.13 19.57 Favored 'General case' 0 C--O 1.244 0.772 0 C-N-CA 123.845 0.858 . . . . 74.13 108.691 176.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -78.37 153.24 31.79 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 120.875 0.369 . . . . 70.34 111.329 -177.612 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 47.5 t-80 -109.92 94.28 4.94 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 108.045 -1.094 . . . . 62.44 108.045 173.172 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 65.0 t60 . . . . . 0 C--O 1.25 1.095 0 N-CA-C 108.981 -0.748 . . . . 74.35 108.981 179.313 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.0 mmm . . . . . 0 CA--C 1.549 0.92 0 N-CA-C 109.137 -0.69 . . . . 63.34 109.137 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -73.64 116.55 4.72 Favored 'Trans proline' 0 C--N 1.378 2.125 0 C-N-CA 122.514 2.142 . . . . 63.22 111.292 -179.19 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 89.4 p -74.46 143.6 44.59 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 108.856 -0.794 . . . . 75.13 108.856 176.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.457 ' O ' ' HD3' ' A' ' 8' ' ' LYS . 28.7 tt0 -64.56 -30.27 71.3 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 110.507 -0.182 . . . . 72.52 110.507 -178.792 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.424 ' HA ' ' HE2' ' A' ' 8' ' ' LYS . 44.9 tt0 -65.56 -36.62 84.32 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 122.964 0.505 . . . . 73.21 111.077 176.143 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -62.45 -35.11 78.27 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.411 0.684 . . . . 72.23 109.912 171.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.548 ' O ' HG23 ' A' ' 11' ' ' VAL . 29.6 mm-40 -67.48 -49.47 63.4 Favored 'General case' 0 C--N 1.35 0.599 0 CA-C-O 118.604 -0.712 . . . . 75.3 110.413 -179.503 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.68 ' HG3' HD13 ' A' ' 40' ' ' ILE . 4.0 mppt? -57.16 -37.33 71.92 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-N 118.228 0.467 . . . . 53.33 111.321 175.267 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.585 ' HA ' ' HE2' ' A' ' 12' ' ' LYS . 77.0 ttt180 -59.51 -43.53 93.37 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 123.642 0.589 . . . . 75.05 110.772 177.902 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.484 ' O ' HG23 ' A' ' 14' ' ' VAL . 49.4 mt-30 -64.76 -43.67 92.57 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 115.122 -0.945 . . . . 72.23 110.53 175.203 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.548 HG23 ' O ' ' A' ' 7' ' ' GLU . 74.7 t -62.81 -39.07 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 C-N-CA 124.499 1.12 . . . . 65.51 111.961 -176.27 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.585 ' HE2' ' HA ' ' A' ' 9' ' ' ARG . 49.7 mtmt -64.55 -36.16 83.31 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.291 0.637 . . . . 63.4 110.57 178.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.521 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.6 tt0 -67.09 -49.11 66.1 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 124.067 0.854 . . . . 70.45 109.889 175.399 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 10' ' ' GLN . 61.3 t -59.06 -32.42 47.81 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 123.387 0.675 . . . . 74.11 110.571 178.398 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.466 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -73.15 -49.36 28.68 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.254 1.021 . . . . 65.32 111.975 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -68.95 -36.64 78.15 Favored 'General case' 0 N--CA 1.479 1.008 0 O-C-N 123.753 0.658 . . . . 75.43 111.416 -173.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.521 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 16.0 mm-40 -64.65 -39.76 94.27 Favored 'General case' 0 C--N 1.353 0.719 0 O-C-N 123.711 0.632 . . . . 74.11 110.821 -177.91 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.405 ' HG3' HG21 ' A' ' 68' ' ' VAL . 14.8 mmmm -73.76 -29.92 62.49 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.122 0.569 . . . . 75.13 111.52 -178.837 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.497 ' HB3' HD12 ' A' ' 46' ' ' LEU . 64.7 mt -71.09 -32.17 68.73 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.041 0.537 . . . . 62.5 111.41 171.215 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.9 mt -71.02 -32.42 69.18 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.306 0.642 . . . . 72.33 110.222 173.091 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 21.8 mm-40 -61.86 -44.53 96.64 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.147 0.579 . . . . 71.24 110.306 176.08 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -71.01 -42.91 68.96 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.109 -0.95 . . . . 61.34 111.457 -179.147 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.9 t -138.82 91.74 11.62 Favored Pre-proline 0 C--O 1.241 0.632 0 CA-C-N 116.03 -0.532 . . . . 74.11 110.483 -177.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -72.33 -12.38 27.45 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 122.925 2.417 . . . . 73.33 111.539 165.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -69.98 -25.06 63.44 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 124.685 1.194 . . . . 73.02 111.236 177.844 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 7.4 m -116.95 146.25 43.11 Favored 'General case' 0 C--O 1.239 0.548 0 C-N-CA 123.705 0.802 . . . . 73.23 110.758 -176.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -94.65 120.94 35.67 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 107.648 -1.242 . . . . 50.32 107.648 172.402 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 47.6 t -97.56 135.42 32.01 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 C-N-CA 123.812 0.845 . . . . 74.35 109.481 -173.123 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 54.8 tp60 -130.99 133.69 46.02 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.449 0.7 . . . . 73.11 109.312 -178.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.576 HG11 ' HD2' ' A' ' 12' ' ' LYS . 53.5 t -59.95 118.84 3.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 123.101 0.561 . . . . 75.13 110.463 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.489 ' H ' ' HA ' ' A' ' 44' ' ' LEU . 26.3 tpt180 -90.4 -49.47 6.5 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.514 0.726 . . . . 73.21 109.701 -173.253 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 18.8 ttt180 -160.86 151.39 18.13 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.845 0.858 . . . . 61.14 109.774 -178.55 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.401 HG21 ' HD3' ' A' ' 12' ' ' LYS . 64.1 t -114.97 128.43 72.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 123.62 0.768 . . . . 75.02 109.214 173.78 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -117.22 137.6 52.26 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 124.677 1.191 . . . . 72.11 107.897 176.459 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -107.54 119.99 40.95 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 107.364 -1.347 . . . . 64.42 107.364 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -130.7 75.66 1.67 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.714 0.806 . . . . 71.33 108.882 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 63.02 -114.48 6.94 Favored Glycine 0 C--N 1.348 1.21 0 CA-C-N 114.932 -1.031 . . . . 40.2 112.724 -178.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -82.89 -21.16 34.32 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.111 0.565 . . . . 54.52 110.906 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.429 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 24.7 m -100.62 104.22 15.54 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.704 0.801 . . . . 73.22 110.67 -178.628 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.68 HD13 ' HG3' ' A' ' 8' ' ' LYS . 77.9 mt -83.77 109.12 16.91 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 N-CA-C 108.806 -0.812 . . . . 73.14 108.806 172.598 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.571 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 64.2 mtt180 -88.84 95.46 10.3 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.133 0.973 . . . . 70.5 110.045 -179.328 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 57.0 t -87.92 110.71 21.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 N-CA-C 109.08 -0.711 . . . . 72.23 109.08 176.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -76.43 134.1 39.68 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 109.429 -0.582 . . . . 73.24 109.429 169.122 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.489 ' HA ' ' H ' ' A' ' 31' ' ' ARG . 4.3 mp -131.78 168.4 17.87 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.058 0.543 . . . . 53.33 109.803 174.822 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -110.17 130.15 55.59 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 107.615 -1.254 . . . . 72.43 107.615 -179.596 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.627 ' HB3' ' CE2' ' A' ' 55' ' ' TYR . 6.8 tt -139.74 135.66 33.35 Favored 'General case' 0 C--O 1.249 1.057 0 N-CA-C 106.472 -1.677 . . . . 52.02 106.472 -179.516 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 83.1 mtt180 -103.39 99.52 9.36 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.448 -0.796 . . . . 74.02 110.557 -166.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 36.3 m -72.73 87.11 1.25 Allowed 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 108.901 -0.777 . . . . 65.54 108.901 176.679 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 55.4 m-20 60.48 31.78 20.37 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 124.734 1.214 . . . . 65.44 110.555 -171.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.15 -10.16 59.89 Favored Glycine 0 C--N 1.351 1.404 0 CA-C-N 115.666 -0.697 . . . . 41.52 114.31 -177.079 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.567 ' HE3' ' HA ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -75.47 129.09 36.72 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 117.93 0.865 . . . . 73.44 110.362 179.065 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.78 115.65 21.1 Favored 'General case' 0 C--O 1.238 0.48 0 C-N-CA 123.599 0.76 . . . . 75.43 109.814 -172.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 14.5 mp0 -129.6 139.31 51.5 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.346 0.658 . . . . 53.31 109.722 170.596 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -92.56 122.55 35.09 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.913 0.885 . . . . 64.13 109.181 172.226 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.627 ' CE2' ' HB3' ' A' ' 46' ' ' LEU . 12.0 m-85 -107.23 116.7 32.4 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 108.472 -0.936 . . . . 74.14 108.472 179.067 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 29.8 m -88.77 99.33 12.28 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 107.589 -1.263 . . . . 73.21 107.589 177.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.561 HG13 HG12 ' A' ' 71' ' ' ILE . 47.0 t -91.84 103.64 14.75 Favored 'Isoleucine or valine' 0 C--O 1.239 0.545 0 N-CA-C 107.339 -1.356 . . . . 73.12 107.339 -178.201 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.571 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 43.1 mt-10 -85.44 101.66 12.8 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.136 -1.393 . . . . 70.22 108.759 -174.708 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.491 ' HB ' HG13 ' A' ' 11' ' ' VAL . 34.5 t -112.09 112.75 41.86 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 C-N-CA 123.985 0.914 . . . . 63.41 108.944 -175.026 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.624 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 42.1 tt0 -105.04 149.39 25.84 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.586 0.755 . . . . 72.31 111.164 -174.744 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -77.11 112.02 13.31 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.687 0.795 . . . . 62.12 109.188 173.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -121.21 111.69 17.71 Favored 'General case' 0 C--O 1.242 0.694 0 N-CA-C 107.891 -1.152 . . . . 73.52 107.891 171.364 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 75.09 -109.35 2.76 Favored Glycine 0 C--N 1.346 1.121 0 N-CA-C 110.778 -0.929 . . . . 55.11 110.778 -174.502 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -123.13 5.61 9.22 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.328 0.651 . . . . 62.22 109.822 176.371 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 67.9 p -110.54 148.0 33.02 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.382 0.673 . . . . 74.44 110.912 -176.16 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -96.17 112.02 23.89 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.185 0.994 . . . . 74.33 108.826 173.541 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.0 t -113.79 131.31 56.27 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 123.666 0.786 . . . . 72.42 110.211 -173.111 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.407 HG22 HG22 ' A' ' 59' ' ' VAL . 98.4 t -70.28 107.71 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 N-CA-C 109.247 -0.649 . . . . 53.51 109.247 174.264 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.624 ' HD3' ' HB3' ' A' ' 60' ' ' GLU . 30.6 mmmt -66.82 -52.83 39.19 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 115.23 -0.895 . . . . 73.44 109.498 176.288 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.5 ptt180 -162.71 164.9 26.2 Favored 'General case' 0 C--O 1.241 0.636 0 CA-C-N 114.508 -1.224 . . . . 51.43 109.779 -179.469 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.561 HG12 HG13 ' A' ' 57' ' ' VAL . 41.5 mt -121.93 107.69 20.44 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 C-N-CA 123.947 0.899 . . . . 35.15 108.606 175.527 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 36.4 m -93.22 103.82 16.05 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.6 0.76 . . . . 63.34 109.836 -176.327 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 36.9 ttt180 -79.43 133.89 36.55 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.012 0.525 . . . . 62.41 109.63 175.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 8.1 t -84.87 151.0 24.6 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 109.45 -0.574 . . . . 74.23 109.45 170.333 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 8.6 p -119.86 145.53 25.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 N-CA-C 108.604 -0.888 . . . . 74.01 108.604 177.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -65.25 -43.35 95.42 Favored Glycine 0 C--N 1.351 1.406 0 O-C-N 123.277 0.361 . . . . 42.24 112.431 -178.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.4 t -146.58 167.57 23.39 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.822 0.849 . . . . 71.23 109.765 179.119 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.4 pp -151.32 26.72 0.68 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.223 0.609 . . . . 55.41 111.277 -172.388 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -132.99 179.53 6.12 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.378 0.671 . . . . 72.35 112.368 -173.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 16.8 p80 -142.8 102.27 4.0 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 105.979 -1.86 . . . . 72.03 105.979 165.149 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 45.8 p-80 -64.37 140.58 58.88 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 116.033 -0.531 . . . . 70.15 111.649 -174.091 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 22.7 m170 -75.31 162.09 28.72 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 108.661 -0.866 . . . . 74.23 108.661 171.406 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 15.9 p-80 54.44 175.3 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.88 0 C-N-CA 126.112 1.765 . . . . 74.12 112.82 -169.492 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 37.5 m80 -132.47 149.92 52.25 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.474 0.71 . . . . 75.13 109.319 179.203 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 21.9 m-70 . . . . . 0 C--O 1.251 1.146 0 C-N-CA 123.564 0.746 . . . . 53.44 109.161 179.045 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.5 ttm . . . . . 0 N--CA 1.478 0.972 0 N-CA-C 109.561 -0.533 . . . . 74.42 109.561 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -60.76 110.96 0.91 Allowed 'Trans proline' 0 C--N 1.384 2.419 0 C-N-CA 122.391 2.06 . . . . 64.23 111.691 175.205 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 40.2 m -81.32 15.81 1.85 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 123.514 0.725 . . . . 72.23 111.726 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -49.59 -36.68 24.83 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.183 1.393 . . . . 60.22 112.748 -178.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -75.64 -36.61 60.13 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.545 0.738 . . . . 72.31 111.046 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -70.6 -22.97 62.49 Favored 'General case' 0 C--N 1.349 0.584 0 CA-C-N 115.161 -0.927 . . . . 73.13 110.376 174.258 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.539 ' O ' HG23 ' A' ' 11' ' ' VAL . 33.5 mm-40 -63.15 -49.76 73.05 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-O 118.988 -0.53 . . . . 74.11 110.02 177.333 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.46 -25.82 68.19 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 112.153 0.427 . . . . 75.12 112.153 178.646 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -63.65 -45.46 90.09 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.067 0.46 . . . . 75.34 109.832 172.406 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.401 ' O ' HG23 ' A' ' 14' ' ' VAL . 49.0 mt-30 -69.04 -37.73 78.74 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 115.229 -0.896 . . . . 72.23 110.843 177.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 7' ' ' GLU . 79.7 t -66.23 -50.68 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 123.806 0.842 . . . . 63.24 111.769 -174.351 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.512 ' HD3' HG21 ' A' ' 33' ' ' VAL . 34.3 mtmm -65.84 -32.86 74.62 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 123.236 0.335 . . . . 71.43 111.036 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -65.89 -53.52 38.51 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 123.728 0.642 . . . . 45.15 110.285 177.082 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.472 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 78.9 t -59.2 -37.72 70.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 C-N-CA 123.03 0.532 . . . . 75.43 110.351 178.446 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.36 -44.77 86.59 Favored 'General case' 0 C--O 1.246 0.901 0 C-N-CA 123.613 0.765 . . . . 73.51 111.899 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -71.38 -31.24 67.08 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 116.396 -0.365 . . . . 72.23 110.591 -178.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.493 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 47.1 mt-10 -65.79 -39.86 91.36 Favored 'General case' 0 C--N 1.355 0.816 0 O-C-N 123.899 0.749 . . . . 61.44 110.686 179.766 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.5 ' HB2' HD11 ' A' ' 71' ' ' ILE . 67.8 mmtt -73.21 -28.2 62.04 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-O 120.81 0.338 . . . . 72.23 110.69 178.718 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.571 ' HB3' HD12 ' A' ' 46' ' ' LEU . 53.3 mt -70.2 -31.09 68.37 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.971 0.509 . . . . 73.34 111.069 169.472 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.1 mt -79.68 -17.95 52.49 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.891 0.876 . . . . 65.13 110.946 175.402 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 8.7 mm-40 -71.63 -41.05 69.29 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 109.736 -0.468 . . . . 74.0 109.736 172.278 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -76.54 -37.25 56.94 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 115.276 -0.875 . . . . 64.41 110.554 178.293 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.3 t -153.69 86.42 3.9 Favored Pre-proline 0 CA--C 1.551 1.006 0 C-N-CA 123.693 0.797 . . . . 43.12 110.779 -173.097 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo -78.37 -19.22 11.91 Favored 'Trans proline' 0 C--N 1.374 1.92 0 C-N-CA 122.505 2.137 . . . . 40.02 112.629 177.568 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -77.44 -19.68 55.67 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.68 0.792 . . . . 73.31 111.05 -175.24 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 31.4 m -100.13 141.58 32.76 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.178 0.591 . . . . 73.12 110.047 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -77.4 119.85 21.58 Favored 'General case' 0 C--O 1.243 0.755 0 C-N-CA 124.03 0.932 . . . . 72.41 109.546 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.9 t -98.32 112.4 30.33 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 N-CA-C 109.429 -0.582 . . . . 55.34 109.429 -178.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.435 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 30.7 mm-40 -94.93 174.42 7.1 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.353 1.061 . . . . 64.33 109.367 172.882 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.457 HG11 ' HD2' ' A' ' 12' ' ' LYS . 47.1 t -106.38 137.21 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 N-CA-C 108.961 -0.755 . . . . 61.45 108.961 169.352 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -102.7 -54.2 2.7 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.936 0.495 . . . . 74.11 110.19 179.521 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -153.88 147.84 25.55 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.994 0.918 . . . . 72.22 109.103 -176.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.531 HG13 HG22 ' A' ' 42' ' ' VAL . 88.1 t -121.51 118.83 57.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 N-CA-C 108.347 -0.983 . . . . 64.15 108.347 176.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -116.66 109.87 17.75 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.146 0.578 . . . . 63.34 109.743 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.52 ' HG2' HG12 ' A' ' 40' ' ' ILE . 2.8 tmtp? -83.65 117.25 23.06 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 107.138 -1.43 . . . . 75.12 107.138 178.664 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.0 89.88 2.81 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 108.983 -0.747 . . . . 71.41 108.983 -178.338 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.407 ' O ' ' HE2' ' A' ' 35' ' ' LYS . . . 69.08 -111.46 3.94 Favored Glycine 0 C--N 1.344 1.023 0 O-C-N 123.612 0.57 . . . . 74.12 113.464 173.41 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -96.92 1.14 50.09 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.29 0.636 . . . . 73.42 111.388 177.521 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 23.7 m -131.24 107.88 9.3 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.327 0.651 . . . . 71.3 110.211 -176.143 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.535 HD12 HG21 ' A' ' 11' ' ' VAL . 33.7 mt -83.62 107.46 15.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 N-CA-C 108.497 -0.927 . . . . 71.45 108.497 172.089 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.527 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 98.1 mtt180 -86.36 95.27 9.6 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 109.008 -0.738 . . . . 75.11 109.008 176.097 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.531 HG22 HG13 ' A' ' 33' ' ' VAL . 58.5 t -86.73 113.48 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 N-CA-C 108.762 -0.829 . . . . 64.43 108.762 177.194 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -86.98 104.42 16.28 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 124.087 0.955 . . . . 64.31 108.518 174.523 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.435 ' HB3' ' O ' ' A' ' 29' ' ' GLN . 4.8 mp -97.24 165.93 11.81 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 109.754 -0.461 . . . . 52.5 109.754 179.393 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -116.64 104.85 11.8 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.119 0.485 . . . . 72.42 109.983 -179.575 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.571 HD12 ' HB3' ' A' ' 19' ' ' LEU . 6.8 tt -107.42 129.39 54.94 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 106.927 -1.508 . . . . 73.4 106.927 177.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 55.8 mtm180 -99.95 102.17 13.48 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 108.48 -0.933 . . . . 61.41 108.48 -178.302 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 25.4 m -94.74 107.15 19.16 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.418 1.087 . . . . 62.41 109.686 -175.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 21.2 m120 61.31 27.68 17.31 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 124.065 0.946 . . . . 74.43 112.06 179.377 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 97.65 -19.56 54.17 Favored Glycine 0 C--N 1.347 1.153 0 CA-C-N 116.119 -0.491 . . . . 51.21 112.98 -178.57 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 45.0 mtmt -74.09 124.43 26.28 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 109.288 -0.634 . . . . 74.22 109.288 177.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -82.35 110.86 17.88 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 108.562 -0.903 . . . . 72.3 108.562 178.104 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -126.26 145.38 50.43 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.17 0.588 . . . . 75.13 110.17 -177.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -108.32 129.98 55.21 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.207 0.603 . . . . 52.54 109.421 177.263 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.467 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 42.0 m-85 -113.91 118.93 35.58 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 108.911 -0.774 . . . . 73.14 108.911 179.085 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 31.9 m -83.57 101.45 11.47 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 108.948 -0.76 . . . . 34.34 108.948 176.192 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.464 HG13 HG12 ' A' ' 71' ' ' ILE . 48.0 t -94.91 110.38 23.81 Favored 'Isoleucine or valine' 0 C--O 1.239 0.514 0 CA-C-N 115.24 -0.891 . . . . 72.5 109.274 179.362 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.527 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 37.3 mt-10 -78.66 106.35 10.58 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.961 0.904 . . . . 70.1 109.089 177.095 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.549 HG22 HG22 ' A' ' 68' ' ' VAL . 41.6 t -111.65 114.36 46.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 N-CA-C 108.657 -0.868 . . . . 73.42 108.657 178.009 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -102.26 155.88 17.93 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.279 1.032 . . . . 64.0 110.781 -171.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.448 ' NH2' ' HA ' ' A' ' 64' ' ' ASN . 14.6 tpt180 -89.35 133.09 34.65 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.637 0.775 . . . . 75.15 110.146 -177.216 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -141.22 91.85 2.43 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 108.729 -0.841 . . . . 74.41 108.729 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.94 -102.78 1.03 Allowed Glycine 0 C--N 1.345 1.031 0 CA-C-N 116.095 -0.502 . . . . 44.52 112.707 179.59 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.448 ' HA ' ' NH2' ' A' ' 61' ' ' ARG . 19.8 m-80 -115.15 1.94 13.99 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.158 0.983 . . . . 73.14 111.174 177.687 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 71.5 p -115.51 166.63 11.68 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.812 0.845 . . . . 72.44 110.769 -178.415 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -117.65 136.37 53.37 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.116 0.966 . . . . 73.45 108.77 174.21 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 6.2 t -126.01 122.38 35.72 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.004 0.921 . . . . 64.44 110.048 -175.25 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.549 HG22 HG22 ' A' ' 59' ' ' VAL . 86.2 t -73.59 115.83 15.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 122.593 0.357 . . . . 72.12 110.203 178.23 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -74.57 -57.07 4.16 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.028 0.931 . . . . 73.44 110.441 178.038 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -160.47 148.2 16.2 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 116.174 -0.466 . . . . 72.32 110.683 -178.612 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.5 HD11 ' HB2' ' A' ' 18' ' ' LYS . 47.0 mt -105.44 106.78 21.16 Favored 'Isoleucine or valine' 0 C--O 1.24 0.596 0 N-CA-C 108.608 -0.886 . . . . 63.51 108.608 168.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 66.7 m -109.57 115.59 30.18 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.683 0.793 . . . . 72.24 108.92 176.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.467 ' HA ' ' HA ' ' A' ' 55' ' ' TYR . 49.4 ttp180 -68.38 145.66 53.94 Favored 'General case' 0 C--O 1.243 0.722 0 N-CA-C 109.473 -0.566 . . . . 63.15 109.473 176.283 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 14.6 t -62.3 134.95 57.2 Favored 'General case' 0 C--O 1.242 0.69 0 O-C-N 123.863 0.727 . . . . 72.11 110.081 -179.464 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 11.4 p -92.02 152.09 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 C-N-CA 123.194 0.598 . . . . 63.23 109.444 179.232 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -165.43 45.3 0.28 Allowed Glycine 0 C--N 1.339 0.71 0 N-CA-C 111.076 -0.81 . . . . 63.13 111.076 178.393 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.3 t -81.16 -173.8 4.52 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.622 0.769 . . . . 63.24 110.56 -177.8 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 96.5 mt -73.72 75.68 1.55 Allowed 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 121.424 0.63 . . . . 74.31 109.697 175.545 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -106.02 166.78 10.25 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.442 -0.799 . . . . 75.15 110.404 -174.006 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 -71.36 96.76 1.5 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.889 0.876 . . . . 73.33 111.114 -174.003 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -69.3 130.52 42.82 Favored 'General case' 0 C--O 1.242 0.663 0 C-N-CA 123.645 0.778 . . . . 74.35 109.094 176.108 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 86.3 t60 63.11 84.88 0.14 Allowed 'General case' 0 CA--C 1.549 0.926 0 O-C-N 124.567 1.167 . . . . 73.41 110.211 -169.255 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -126.33 13.92 7.7 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.26 1.024 . . . . 70.35 111.084 -175.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 26.2 p80 -149.46 157.54 43.38 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.413 0.685 . . . . 75.31 109.963 171.129 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 41.6 m-70 . . . . . 0 N--CA 1.477 0.894 0 C-N-CA 123.778 0.831 . . . . 71.13 110.11 175.633 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.6 mtt . . . . . 0 N--CA 1.483 1.192 0 CA-C-O 119.384 -0.341 . . . . 74.43 110.137 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -67.88 113.95 3.19 Favored 'Trans proline' 0 C--N 1.382 2.308 0 C-N-CA 122.866 2.378 . . . . 74.44 112.759 -176.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.6 t -81.35 178.91 8.09 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.527 0.731 . . . . 61.32 111.192 176.211 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -60.78 -24.17 65.58 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.172 0.589 . . . . 72.32 111.453 173.669 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -70.43 -42.57 71.38 Favored 'General case' 0 C--O 1.242 0.695 0 C-N-CA 123.171 0.588 . . . . 72.3 110.391 175.148 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.5 mm-40 -63.88 -21.12 66.31 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 112.744 0.646 . . . . 74.02 112.744 -176.045 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.575 ' O ' HG23 ' A' ' 11' ' ' VAL . 77.2 mt-10 -57.14 -56.89 15.95 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 124.085 0.866 . . . . 74.54 109.407 170.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -69.21 -32.21 71.32 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.257 0.623 . . . . 73.33 110.71 -176.427 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 29.8 mmt180 -55.45 -48.98 73.63 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.564 0.746 . . . . 62.2 110.122 174.509 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.547 ' O ' HG23 ' A' ' 14' ' ' VAL . 64.7 mt-30 -64.32 -45.38 88.15 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 114.26 -1.336 . . . . 70.31 111.16 178.172 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.619 HG21 HD12 ' A' ' 40' ' ' ILE . 59.0 t -61.53 -44.51 98.72 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 123.23 0.612 . . . . 73.33 111.899 -176.044 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt -65.19 -34.25 77.94 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.092 0.557 . . . . 71.01 110.24 178.27 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.48 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 58.1 tt0 -64.59 -51.7 61.33 Favored 'General case' 0 C--N 1.352 0.704 0 CA-C-N 115.656 -0.702 . . . . 72.5 110.418 175.192 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.547 HG23 ' O ' ' A' ' 10' ' ' GLN . 45.0 t -56.5 -46.75 82.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 C-N-CA 123.129 0.572 . . . . 74.12 109.578 -179.307 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.454 ' HB1' HD11 ' A' ' 44' ' ' LEU . . . -60.23 -47.5 85.72 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 114.896 -1.047 . . . . 62.41 112.29 -179.305 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -71.1 -35.4 71.8 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 122.822 0.449 . . . . 74.45 111.321 -175.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 36.4 mm-40 -69.09 -34.6 75.35 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.933 0.493 . . . . 75.51 111.021 -179.678 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.606 ' HB3' HD11 ' A' ' 71' ' ' ILE . 75.2 mmtt -68.16 -35.43 78.06 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.955 0.502 . . . . 70.31 111.063 176.102 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.551 ' HB3' HD12 ' A' ' 46' ' ' LEU . 29.8 mt -68.05 -31.84 71.78 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 115.518 -0.764 . . . . 74.33 111.291 174.657 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 84.9 mt -73.75 -26.11 60.5 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.927 0.891 . . . . 73.4 111.268 174.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 62.9 mm-40 -66.94 -40.68 87.63 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.652 0.381 . . . . 73.1 110.288 173.309 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -72.89 -40.92 65.19 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 123.892 0.745 . . . . 74.13 111.087 178.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.2 t -142.68 99.79 5.64 Favored Pre-proline 0 CA--C 1.548 0.867 0 CA-C-N 115.358 -0.837 . . . . 63.45 109.349 -175.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -79.61 -3.5 12.95 Favored 'Trans proline' 0 C--N 1.38 2.219 0 C-N-CA 122.598 2.198 . . . . 74.43 111.995 171.135 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -101.07 21.63 13.55 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.015 1.326 . . . . 74.55 110.269 -179.29 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 92.9 p -125.89 153.46 44.16 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 112.321 0.489 . . . . 51.42 112.321 -175.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -96.76 121.98 39.21 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 108.327 -0.99 . . . . 54.11 108.327 164.51 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 38.7 t -100.95 113.21 36.27 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 122.919 0.488 . . . . 73.12 109.739 177.269 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -96.74 159.4 14.95 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.225 1.01 . . . . 71.31 108.752 170.367 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.6 p -98.85 118.3 45.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 N-CA-C 108.413 -0.958 . . . . 72.04 108.413 170.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 21.8 tpt180 -85.78 -57.65 2.96 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 123.035 0.534 . . . . 72.12 110.429 -174.42 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.0 tpt180 -156.61 144.14 19.14 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.511 0.724 . . . . 75.31 109.753 -172.269 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 86.0 t -127.95 122.75 59.23 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 123.139 0.576 . . . . 72.32 110.282 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -106.8 129.53 54.65 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.641 1.176 . . . . 74.52 108.863 169.704 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.473 ' HG2' HG12 ' A' ' 40' ' ' ILE . 13.1 tmtt? -104.88 108.08 19.38 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 106.989 -1.486 . . . . 75.24 106.989 173.191 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -122.66 93.29 3.92 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.273 0.629 . . . . 73.41 110.173 -177.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 70.08 -98.13 0.62 Allowed Glycine 0 C--N 1.35 1.346 0 CA-C-N 115.497 -0.774 . . . . 73.22 112.343 178.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 47.5 m-80 -111.08 -29.25 7.96 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.052 0.541 . . . . 72.32 110.21 173.182 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 19.0 m -83.97 101.47 11.74 Favored 'General case' 0 C--N 1.352 0.69 0 CA-C-O 121.112 0.482 . . . . 63.33 110.204 -178.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.619 HD12 HG21 ' A' ' 11' ' ' VAL . 31.1 mt -87.95 112.69 23.95 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 CA-C-N 115.838 -0.619 . . . . 64.52 109.533 172.538 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.498 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 90.2 mtt180 -81.84 97.77 8.18 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 123.725 0.81 . . . . 73.14 109.645 174.346 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.431 HG12 ' HG ' ' A' ' 44' ' ' LEU . 61.2 t -91.3 107.42 18.69 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 N-CA-C 107.88 -1.156 . . . . 65.54 107.88 172.137 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -82.85 122.16 27.87 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 114.984 -1.007 . . . . 74.44 108.392 168.527 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.454 HD11 ' HB1' ' A' ' 15' ' ' ALA . 2.5 mp -116.41 153.64 31.7 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 109.358 -0.608 . . . . 74.15 109.358 -179.56 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.439 ' HG3' ' HD3' ' A' ' 52' ' ' LYS . 31.2 tt0 -111.42 103.89 12.29 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 109.301 -0.629 . . . . 74.12 109.301 175.594 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.551 HD12 ' HB3' ' A' ' 19' ' ' LEU . 7.3 tt -102.38 154.0 19.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.419 1.088 . . . . 74.34 109.444 -174.875 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 62.9 mtp180 -129.93 97.07 4.37 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.439 0.696 . . . . 73.44 110.64 177.493 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 86.2 m -80.25 102.46 9.5 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 108.95 -0.759 . . . . 64.45 108.95 176.036 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 62.49 26.43 15.73 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.38 0.672 . . . . 54.03 110.859 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.6 -20.27 51.09 Favored Glycine 0 C--N 1.354 1.565 0 CA-C-N 115.758 -0.655 . . . . 21.42 113.329 -177.546 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -69.38 123.02 20.11 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 109.672 -0.492 . . . . 72.01 109.672 177.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.439 ' HD3' ' HG3' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -88.82 112.99 23.89 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 108.814 -0.81 . . . . 74.24 108.814 -170.828 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -128.1 111.94 14.04 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.565 1.146 . . . . 64.4 109.061 178.359 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -78.78 133.68 37.07 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 109.067 -0.716 . . . . 75.52 109.067 173.511 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.421 ' HE2' HD22 ' A' ' 46' ' ' LEU . 75.9 m-85 -114.41 171.72 7.45 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.431 0.692 . . . . 75.13 109.887 172.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 86.2 m -143.88 102.64 3.93 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 106.7 -1.593 . . . . 73.31 106.7 175.236 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.441 HG22 HG12 ' A' ' 71' ' ' ILE . 46.9 t -98.84 105.06 16.8 Favored 'Isoleucine or valine' 0 C--O 1.243 0.723 0 N-CA-C 107.608 -1.256 . . . . 74.32 107.608 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.498 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 28.1 mt-10 -80.52 102.3 9.65 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 115.442 -0.799 . . . . 74.2 109.433 178.562 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.554 HG22 HG22 ' A' ' 68' ' ' VAL . 25.9 t -105.71 115.67 47.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 C-N-CA 124.109 0.963 . . . . 72.41 108.711 -178.697 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.598 ' HB3' ' HE2' ' A' ' 69' ' ' LYS . 35.6 tt0 -102.25 154.76 18.73 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.72 0.808 . . . . 64.51 110.023 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 29.5 ttp180 -80.29 139.64 36.55 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 120.958 0.408 . . . . 64.02 111.733 177.026 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -127.09 103.18 7.3 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.89 1.276 . . . . 75.41 107.642 172.308 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.31 -110.76 3.52 Favored Glycine 0 CA--C 1.53 1.007 0 N-CA-C 111.533 -0.627 . . . . 71.14 111.533 -173.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -101.34 -21.62 14.8 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.01 0.524 . . . . 71.14 110.869 170.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.8 p -86.22 174.73 8.91 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.193 0.597 . . . . 62.24 110.53 -172.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 89.3 m95 -124.98 147.38 48.95 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.625 0.77 . . . . 71.11 108.936 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.2 t -145.91 135.35 23.07 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.078 0.551 . . . . 73.3 110.224 -170.399 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.595 HG21 ' HG3' ' A' ' 18' ' ' LYS . 70.5 t -85.08 129.76 37.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 123.62 0.768 . . . . 75.13 110.593 -176.883 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.598 ' HE2' ' HB3' ' A' ' 60' ' ' GLU . 74.8 mmtt -81.5 -50.39 9.46 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.916 -0.583 . . . . 62.0 109.871 175.229 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 26.9 ptt-85 -168.83 167.63 10.92 Favored 'General case' 0 C--O 1.245 0.84 0 CA-C-N 115.35 -0.841 . . . . 64.5 110.111 -177.783 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.606 HD11 ' HB3' ' A' ' 18' ' ' LYS . 59.5 mt -117.81 109.09 26.26 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 115.089 -0.96 . . . . 74.33 108.851 173.568 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 34.2 m -102.56 124.3 47.86 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 109.677 -0.49 . . . . 44.15 109.677 178.602 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 46.7 ttp180 -82.82 146.85 28.7 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 108.718 -0.845 . . . . 74.32 108.718 171.226 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.3 t -64.45 151.91 43.01 Favored 'General case' 0 C--O 1.247 0.929 0 C-N-CA 123.034 0.534 . . . . 54.52 110.368 172.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 7.6 p -64.03 110.74 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.042 0 CA-C-O 121.879 0.847 . . . . 63.3 108.792 173.13 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 155.6 150.2 5.53 Favored Glycine 0 N--CA 1.463 0.466 0 CA-C-N 114.042 -1.436 . . . . 74.44 109.891 -170.46 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 10.6 t 64.99 32.28 10.61 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.851 0.86 . . . . 74.4 110.521 -177.47 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -121.48 179.64 4.38 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.529 0.731 . . . . 63.42 110.359 -178.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -70.29 118.76 13.52 Favored 'General case' 0 C--O 1.241 0.64 0 CA-C-N 115.969 -0.56 . . . . 63.2 109.885 173.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 47.0 m80 -71.1 96.89 1.4 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 108.348 -0.982 . . . . 75.43 108.348 169.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 58.2 m80 -67.56 122.03 17.14 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.291 0.636 . . . . 71.12 110.613 -176.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 23.4 m170 -67.96 -41.68 82.06 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 108.64 -0.874 . . . . 75.01 108.64 175.327 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 29.7 p-80 -159.64 -170.54 2.95 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 114.167 -1.378 . . . . 75.24 108.835 176.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.9 p80 -161.34 111.28 1.65 Allowed 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.571 0.748 . . . . 61.13 109.055 174.291 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 25.6 p-80 . . . . . 0 C--O 1.253 1.244 0 C-N-CA 122.858 0.463 . . . . 74.42 110.853 -174.5 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.709 ' SD ' ' HA ' ' A' ' 7' ' ' GLU . 34.2 mtm . . . . . 0 N--CA 1.474 0.756 0 N-CA-C 108.842 -0.799 . . . . 72.2 108.842 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.436 ' HD2' ' HG2' ' A' ' 6' ' ' GLU . 34.8 Cg_endo -63.27 -38.86 41.46 Favored 'Trans proline' 0 C--N 1.372 1.801 0 C-N-CA 122.672 2.248 . . . . 75.24 112.954 177.243 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.6 m -138.63 -178.45 5.31 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.883 0.473 . . . . 70.5 111.166 -178.364 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.32 -35.98 82.65 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.904 0.882 . . . . 71.45 112.679 -169.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -64.36 -32.01 73.44 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 122.916 0.486 . . . . 74.43 111.153 -176.409 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.436 ' HG2' ' HD2' ' A' ' 2' ' ' PRO . 2.6 mp0 -71.84 -24.67 61.74 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 115.359 -0.837 . . . . 74.41 111.528 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.709 ' HA ' ' SD ' ' A' ' 1' ' ' MET . 51.0 mt-10 -56.43 -55.38 34.28 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 109.018 -0.734 . . . . 75.22 109.018 171.076 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.474 ' HG3' HG11 ' A' ' 33' ' ' VAL . 0.6 OUTLIER -55.91 -40.96 73.83 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 124.918 1.386 . . . . 74.32 110.368 -175.27 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 84.1 mtt-85 -55.25 -46.0 76.05 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.233 1.013 . . . . 75.03 110.66 177.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.442 ' O ' HG23 ' A' ' 14' ' ' VAL . 68.3 mm-40 -72.29 -50.89 23.61 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.423 -0.808 . . . . 62.23 110.739 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 7' ' ' GLU . 43.0 t -64.32 -35.98 75.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 124.156 0.982 . . . . 65.44 112.026 -167.921 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 47.2 mtmt -63.1 -41.83 99.45 Favored 'General case' 0 N--CA 1.484 1.237 0 O-C-N 123.277 0.361 . . . . 42.54 110.09 176.116 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.456 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 9.5 tt0 -67.3 -43.94 80.46 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 124.249 0.968 . . . . 72.11 110.315 178.554 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.489 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 98.9 t -60.58 -43.43 94.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.369 0.668 . . . . 75.14 109.682 178.297 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.06 -41.61 73.92 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 114.782 -1.099 . . . . 41.1 112.078 -174.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.403 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 21.0 ptmt -67.13 -36.86 82.78 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 123.484 0.49 . . . . 73.02 110.114 -177.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.464 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 50.8 mt-10 -58.48 -46.01 87.52 Favored 'General case' 0 C--N 1.366 1.285 0 O-C-N 124.306 1.004 . . . . 74.42 109.788 177.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.489 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 31.9 mmmt -56.3 -43.76 79.24 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 124.671 1.232 . . . . 75.43 111.014 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 43.6 mt -72.08 -29.74 64.41 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 114.948 -1.023 . . . . 72.52 111.5 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 97.7 mt -76.03 -25.23 55.45 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.293 0.637 . . . . 73.24 111.108 176.526 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 17.4 mm-40 -67.42 -35.02 78.44 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-O 121.453 0.644 . . . . 74.31 109.911 175.276 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -88.77 -28.6 20.38 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 114.931 -1.031 . . . . 74.24 111.336 -179.152 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.514 ' HB3' HD11 ' A' ' 46' ' ' LEU . 32.4 t -150.93 84.92 5.26 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 123.248 0.619 . . . . 73.51 110.332 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -79.73 -6.41 14.33 Favored 'Trans proline' 0 C--N 1.376 2.019 0 C-N-CA 122.78 2.32 . . . . 75.43 112.946 176.21 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -90.11 7.49 37.62 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.655 0.782 . . . . 72.11 111.754 -178.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 39.9 t -133.25 158.52 42.7 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.375 0.67 . . . . 74.25 109.787 176.331 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -99.81 131.64 45.67 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.734 0.813 . . . . 63.05 108.948 177.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 40.9 t -98.46 129.92 48.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 C-N-CA 123.669 0.787 . . . . 73.11 109.679 -178.623 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -108.95 163.43 13.3 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.842 1.257 . . . . 71.45 109.526 177.197 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.8 p -90.99 119.06 37.45 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 N-CA-C 108.936 -0.765 . . . . 74.45 108.936 172.193 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 32.1 tpt180 -91.08 -58.37 2.49 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 109.195 -0.669 . . . . 55.54 109.195 178.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 -150.84 163.87 37.61 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.695 1.198 . . . . 65.22 109.578 173.518 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.53 HG13 HG22 ' A' ' 42' ' ' VAL . 47.0 t -131.96 115.85 28.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 N-CA-C 108.235 -1.024 . . . . 63.12 108.235 172.859 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 24.3 mp0 -101.23 124.98 47.77 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.363 0.665 . . . . 61.41 110.309 177.555 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.4 tptt -95.79 111.49 23.44 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.543 1.137 . . . . 73.2 109.341 175.325 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 20.1 mp0 -121.26 72.2 0.98 Allowed 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 108.892 -0.781 . . . . 75.53 108.892 175.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 59.33 -104.35 0.53 Allowed Glycine 0 C--N 1.344 0.996 0 CA-C-N 115.353 -0.84 . . . . 55.21 113.121 179.37 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -75.55 -41.56 54.62 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.082 0.553 . . . . 75.25 110.503 -179.24 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.466 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 29.0 m -95.57 117.94 31.36 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.214 0.605 . . . . 61.54 111.144 -175.217 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 38.2 mt -98.04 116.8 41.64 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 123.558 0.743 . . . . 54.41 109.235 169.185 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 61.5 mtt180 -103.37 99.66 9.5 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 108.594 -0.891 . . . . 62.33 108.594 178.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.53 HG22 HG13 ' A' ' 33' ' ' VAL . 39.5 t -85.52 125.87 40.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 109.098 -0.704 . . . . 70.14 109.098 179.767 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -85.93 122.03 29.4 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 107.953 -1.129 . . . . 72.31 107.953 166.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.433 ' O ' ' HA ' ' A' ' 54' ' ' ASN . 4.2 mp -117.53 169.06 9.84 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.073 0.549 . . . . 53.34 109.643 178.052 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -134.19 103.0 5.58 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.224 0.535 . . . . 64.23 109.612 -174.512 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.514 HD11 ' HB3' ' A' ' 23' ' ' SER . 8.7 tt -110.36 134.79 51.95 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 106.831 -1.544 . . . . 64.5 106.831 178.308 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.403 ' HA ' ' O ' ' A' ' 51' ' ' LYS . 74.7 mtt85 -101.74 96.97 7.43 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.463 0.649 . . . . 51.51 110.1 -175.595 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 37.5 m -81.74 104.56 12.22 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 114.996 -1.002 . . . . 71.24 108.616 -179.132 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 17.9 m120 66.34 15.17 10.01 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 124.733 1.213 . . . . 50.24 111.075 -172.371 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.54 -18.81 54.66 Favored Glycine 0 C--N 1.355 1.618 0 CA-C-O 119.563 -0.576 . . . . 74.02 113.495 -172.784 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.403 ' O ' ' HA ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -69.18 136.14 51.64 Favored 'General case' 0 N--CA 1.488 1.45 0 CA-C-N 117.658 0.729 . . . . 51.3 110.723 178.264 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -77.81 100.16 6.2 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.39 0.676 . . . . 61.21 109.664 -175.488 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -105.66 112.87 26.11 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.887 0.875 . . . . 73.35 109.457 175.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.433 ' HA ' ' O ' ' A' ' 44' ' ' LEU . 17.0 m120 -91.65 118.4 30.61 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.128 0.571 . . . . 72.13 110.239 176.68 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -108.14 120.69 43.07 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 109.043 -0.725 . . . . 71.52 109.043 177.817 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 57.0 m -88.31 102.41 14.82 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.841 -0.8 . . . . 74.5 108.841 173.143 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.403 HG13 HD13 ' A' ' 71' ' ' ILE . 96.7 t -93.22 106.09 17.56 Favored 'Isoleucine or valine' 0 C--O 1.24 0.564 0 N-CA-C 108.371 -0.974 . . . . 72.24 108.371 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -86.17 104.28 15.59 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 114.491 -1.232 . . . . 73.21 108.811 -176.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 17.5 t -113.84 128.88 70.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 124.138 0.975 . . . . 65.55 108.7 -178.197 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.466 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 38.2 tt0 -112.33 150.02 31.61 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.089 0.555 . . . . 62.41 110.476 -176.848 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.4 tpp85 -73.08 128.34 35.19 Favored 'General case' 0 C--N 1.35 0.59 0 C-N-CA 123.912 0.885 . . . . 72.24 110.649 -177.617 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -122.95 90.44 3.29 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 107.911 -1.144 . . . . 63.11 107.911 172.029 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 72.2 -103.32 1.29 Allowed Glycine 0 C--N 1.348 1.225 0 CA-C-N 116.127 -0.488 . . . . 54.25 112.603 -177.225 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -119.83 2.9 11.1 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 124.125 0.97 . . . . 74.43 110.247 173.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 18.7 p -113.5 176.59 4.96 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.519 0.728 . . . . 64.43 109.705 176.166 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -118.72 153.36 34.52 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.051 0.941 . . . . 74.01 111.323 -174.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 4.9 t -137.33 117.41 13.41 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.217 1.007 . . . . 64.35 108.741 175.331 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.7 t -69.41 108.46 1.88 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.508 0 N-CA-C 109.254 -0.647 . . . . 74.45 109.254 176.735 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -67.49 -57.53 6.36 Favored 'General case' 0 C--O 1.237 0.432 0 O-C-N 123.983 0.802 . . . . 63.14 110.27 177.621 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -151.36 141.03 21.76 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.117 -0.492 . . . . 74.2 111.329 -172.57 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.403 HD13 HG13 ' A' ' 57' ' ' VAL . 34.1 mm -93.46 105.43 16.82 Favored 'Isoleucine or valine' 0 C--N 1.352 0.692 0 N-CA-C 107.884 -1.154 . . . . 75.3 107.884 165.079 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 74.4 m -96.49 131.17 43.36 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 108.724 -0.843 . . . . 75.11 108.724 173.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -98.31 148.51 23.58 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 108.731 -0.84 . . . . 73.25 108.731 172.789 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.4 t -62.16 122.82 16.54 Favored 'General case' 0 CA--C 1.551 1.017 0 N-CA-C 109.153 -0.684 . . . . 51.45 109.153 170.12 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 4.3 p -74.38 99.2 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 CA-C-O 121.721 0.772 . . . . 73.32 109.515 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -100.96 -120.38 4.61 Favored Glycine 0 C--N 1.341 0.808 0 N-CA-C 110.583 -1.007 . . . . 73.02 110.583 178.166 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 63.8 m -72.33 97.09 1.96 Allowed 'General case' 0 C--O 1.242 0.696 0 N-CA-C 109.182 -0.673 . . . . 70.53 109.182 171.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.4 tt -144.83 106.26 4.23 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 107.131 -1.433 . . . . 44.04 107.131 -177.173 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.6 mp0 -66.85 92.29 0.22 Allowed 'General case' 0 C--O 1.242 0.675 0 N-CA-C 107.773 -1.195 . . . . 63.55 107.773 171.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -66.07 103.62 0.99 Allowed 'General case' 0 C--N 1.346 0.429 0 N-CA-C 109.213 -0.662 . . . . 73.21 109.213 178.275 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 8.5 t-160 -68.22 146.04 53.73 Favored 'General case' 0 C--O 1.243 0.748 0 N-CA-C 108.174 -1.047 . . . . 50.32 108.174 174.372 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 11.5 t-80 -49.99 -39.52 41.35 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.203 1.001 . . . . 72.32 111.612 -176.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 9.1 p80 -162.61 126.59 3.03 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 124.077 0.86 . . . . 72.23 108.843 170.111 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -83.53 -32.95 25.62 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 109.186 -0.672 . . . . 74.14 109.186 168.786 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 61.3 m80 . . . . . 0 C--O 1.247 0.932 0 C-N-CA 123.676 0.791 . . . . 61.12 110.727 -179.591 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.6 ttm . . . . . 0 N--CA 1.48 1.043 0 N-CA-C 109.376 -0.602 . . . . 64.22 109.376 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.82 -11.91 31.71 Favored 'Trans proline' 0 C--N 1.379 2.159 0 C-N-CA 123.294 2.663 . . . . 63.12 114.089 -176.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.4 m 67.65 31.43 6.04 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 125.115 1.366 . . . . 74.31 110.86 -177.182 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -68.42 -26.48 65.55 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.861 1.264 . . . . 64.11 112.1 -175.337 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -88.13 -28.63 21.14 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 121.89 -0.507 . . . . 72.51 110.286 176.679 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.47 ' HA ' ' HD3' ' A' ' 9' ' ' ARG . 37.1 tt0 -79.98 -25.48 40.33 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 116.508 -0.315 . . . . 73.3 111.759 -178.534 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.608 ' HG3' ' HD2' ' A' ' 8' ' ' LYS . 9.7 pt-20 -60.27 -33.95 73.04 Favored 'General case' 0 C--O 1.211 -0.958 0 CA-C-O 119.451 -0.309 . . . . 71.22 110.48 178.512 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.608 ' HD2' ' HG3' ' A' ' 7' ' ' GLU . 12.3 mptt -64.45 -43.86 92.96 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.16 0.584 . . . . 63.22 110.067 175.795 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.485 ' HA ' ' HE2' ' A' ' 12' ' ' LYS . 72.2 mtp180 -57.92 -43.26 86.12 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.117 0.967 . . . . 73.4 110.392 177.767 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.446 ' O ' HG23 ' A' ' 14' ' ' VAL . 52.5 mt-30 -64.71 -46.41 82.45 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 114.537 -1.211 . . . . 62.41 110.839 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.598 HG21 HD12 ' A' ' 40' ' ' ILE . 41.4 t -63.07 -39.7 86.21 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 124.793 1.237 . . . . 72.14 111.927 -177.148 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.485 ' HE2' ' HA ' ' A' ' 9' ' ' ARG . 49.8 mtmt -64.06 -37.5 87.67 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.54 0.736 . . . . 53.41 110.397 178.491 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -71.41 -43.67 66.35 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-N 115.552 -0.749 . . . . 75.34 110.554 179.285 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 10' ' ' GLN . 87.7 t -58.94 -42.3 85.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 124.036 0.934 . . . . 51.21 110.299 176.41 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.34 -48.93 68.66 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 114.825 -1.079 . . . . 42.21 111.777 -177.653 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.424 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 19.8 ptmt -67.09 -28.55 68.27 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 115.755 -0.657 . . . . 55.22 111.051 -175.776 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -60.56 -43.83 96.84 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.429 0.691 . . . . 75.32 111.478 176.031 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.502 ' HG3' HG21 ' A' ' 68' ' ' VAL . 59.3 mmtt -70.54 -26.7 63.69 Favored 'General case' 0 N--CA 1.481 1.108 0 O-C-N 123.708 0.63 . . . . 64.31 110.147 -178.579 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.705 ' HB3' HD12 ' A' ' 46' ' ' LEU . 21.8 mt -75.23 -32.06 61.04 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 115.107 -0.951 . . . . 64.51 111.22 173.481 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 95.4 mt -73.35 -21.79 60.45 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.425 0.69 . . . . 75.2 111.287 175.638 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -66.67 -36.18 81.92 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-O 121.544 0.687 . . . . 73.44 110.09 173.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -81.29 -41.51 22.02 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 114.82 -1.082 . . . . 72.41 111.069 -179.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.4 t -153.96 89.45 3.41 Favored Pre-proline 0 CA--C 1.554 1.114 0 C-N-CA 123.524 0.73 . . . . 73.32 109.364 -174.232 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.33 -26.73 10.13 Favored 'Trans proline' 0 C--N 1.375 1.943 0 C-N-CA 122.809 2.339 . . . . 73.53 113.067 177.026 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -68.9 -25.98 64.87 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.633 0.773 . . . . 70.52 111.298 -174.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 35.0 p -84.11 138.36 33.07 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.781 0.832 . . . . 63.5 110.845 177.636 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.507 ' HB3' ' NH2' ' A' ' 47' ' ' ARG . 2.7 tpmt? -82.31 111.78 18.69 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 108.432 -0.951 . . . . 64.41 108.432 175.165 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 41.0 t -97.45 120.05 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 124.062 0.945 . . . . 71.24 109.512 -173.205 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.431 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 84.5 mm-40 -107.27 172.18 6.97 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.261 1.024 . . . . 54.33 109.219 174.173 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.484 HG21 ' HB3' ' A' ' 12' ' ' LYS . 57.6 t -102.55 123.05 55.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 108.627 -0.879 . . . . 73.34 108.627 176.056 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.5 tpt180 -92.13 -48.13 6.88 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.152 0.581 . . . . 65.04 110.684 -174.811 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -149.26 145.04 26.88 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.572 1.149 . . . . 73.13 107.932 -173.699 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.441 HG22 HG13 ' A' ' 42' ' ' VAL . 86.3 t -125.17 130.6 73.03 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 N-CA-C 108.519 -0.919 . . . . 72.43 108.519 173.161 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -120.43 108.28 13.92 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.15 0.98 . . . . 63.33 109.415 178.327 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.6 tmtt? -97.16 111.97 23.97 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 108.312 -0.995 . . . . 74.13 108.312 -177.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -126.0 86.69 2.56 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.46 0.704 . . . . 72.33 109.48 -176.822 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 60.56 -80.77 0.01 OUTLIER Glycine 0 C--N 1.353 1.489 0 N-CA-C 115.223 0.849 . . . . 42.2 115.223 172.622 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -103.68 -45.81 4.7 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.181 0.993 . . . . 72.13 110.359 -177.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.543 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 8.9 m -100.33 133.69 44.37 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.231 0.613 . . . . 62.2 111.134 -175.687 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.598 HD12 HG21 ' A' ' 11' ' ' VAL . 32.7 mt -110.5 109.01 26.88 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.9 0 C-N-CA 123.481 0.712 . . . . 72.23 109.395 174.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 39.3 mtm180 -86.19 96.77 10.03 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 109.24 -0.652 . . . . 71.14 109.24 176.768 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.47 HG21 HG12 ' A' ' 11' ' ' VAL . 60.7 t -90.82 117.01 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 123.143 0.577 . . . . 73.24 109.47 176.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -91.73 115.28 27.92 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.462 1.105 . . . . 43.13 108.83 174.598 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.431 ' HB3' ' O ' ' A' ' 29' ' ' GLN . 4.1 mp -111.1 159.48 17.78 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 122.025 -0.422 . . . . 55.33 110.375 -176.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -106.48 107.19 18.07 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 109.184 -0.673 . . . . 72.32 109.184 178.225 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.705 HD12 ' HB3' ' A' ' 19' ' ' LEU . 7.1 tt -111.19 125.47 53.83 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 106.918 -1.512 . . . . 73.01 106.918 175.547 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.507 ' NH2' ' HB3' ' A' ' 27' ' ' LYS . 43.4 mtm180 -103.24 95.6 6.21 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 109.282 -0.636 . . . . 61.41 109.282 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 56.9 m -70.99 101.34 2.16 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.503 1.121 . . . . 63.1 110.227 -176.502 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 19.1 m120 60.86 26.19 16.07 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.189 0.995 . . . . 55.12 111.942 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 99.22 2.82 56.8 Favored Glycine 0 C--N 1.352 1.45 0 CA-C-O 119.545 -0.586 . . . . 53.51 113.7 -179.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -103.22 124.14 48.06 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-N 117.686 0.743 . . . . 54.35 109.831 174.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -78.91 119.34 21.95 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 122.884 0.474 . . . . 73.14 110.448 -175.24 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -134.53 122.31 22.23 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.911 1.284 . . . . 64.35 108.276 175.469 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -88.03 140.2 29.74 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 109.787 -0.449 . . . . 70.44 109.787 176.751 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -120.46 121.58 38.8 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.333 0.653 . . . . 73.32 109.562 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 24.6 m -86.97 103.72 15.61 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 108.17 -1.048 . . . . 73.1 108.17 175.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.448 HG13 HD13 ' A' ' 71' ' ' ILE . 58.7 t -102.3 114.81 42.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 124.218 1.007 . . . . 63.32 109.096 -179.181 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -89.02 101.98 14.63 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 109.063 -0.717 . . . . 73.0 109.063 179.37 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.59 ' HB ' HG13 ' A' ' 11' ' ' VAL . 22.2 t -105.11 109.99 29.48 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 C-N-CA 123.551 0.74 . . . . 64.33 109.273 178.055 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.543 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 34.8 tt0 -102.07 144.62 30.43 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.765 1.226 . . . . 73.24 111.039 -172.043 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 7.5 tpp180 -69.73 105.81 2.87 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.643 0.777 . . . . 71.4 109.574 176.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 52.2 tp60 -97.17 86.42 3.94 Favored 'General case' 0 C--O 1.242 0.707 0 N-CA-C 108.58 -0.896 . . . . 72.3 108.58 176.207 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 68.71 -101.02 0.73 Allowed Glycine 0 C--N 1.348 1.2 0 CA-C-N 115.18 -0.918 . . . . 54.13 111.168 -175.691 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -100.37 -33.05 10.54 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.67 1.188 . . . . 60.42 110.25 176.853 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 24.8 p -86.32 177.38 7.49 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.878 0.871 . . . . 64.52 110.814 -178.48 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -111.78 158.94 18.77 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.059 0.944 . . . . 73.41 109.038 172.248 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.5 t -145.99 137.65 24.98 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.675 0.79 . . . . 73.42 109.13 179.461 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.502 HG21 ' HG3' ' A' ' 18' ' ' LYS . 96.7 t -86.03 115.12 26.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 N-CA-C 108.94 -0.763 . . . . 64.31 108.94 176.924 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -74.89 -49.74 19.32 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 124.297 1.039 . . . . 61.33 110.25 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.1 ptp85 -157.89 159.92 37.1 Favored 'General case' 0 C--O 1.244 0.792 0 CA-C-N 115.228 -0.896 . . . . 73.03 111.277 177.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.448 HD13 HG13 ' A' ' 57' ' ' VAL . 36.4 mm -114.41 122.98 69.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 N-CA-C 106.508 -1.664 . . . . 73.33 106.508 167.281 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 11.7 t -126.98 133.93 50.48 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 109.116 -0.698 . . . . 75.2 109.116 171.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 22.1 ttm180 -91.92 140.33 29.78 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.382 -0.97 . . . . 74.13 108.382 176.276 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.3 t -69.87 122.56 19.5 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 108.533 -0.914 . . . . 64.41 108.533 171.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 7.6 p -69.15 112.44 3.93 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.961 0 CA-C-O 121.566 0.698 . . . . 74.3 110.057 -176.331 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -134.16 -38.36 0.21 Allowed Glycine 0 C--N 1.341 0.827 0 N-CA-C 110.112 -1.195 . . . . 43.22 110.112 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 30.0 t -142.18 114.81 8.51 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 108.188 -1.042 . . . . 52.32 108.188 172.536 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -66.72 162.71 20.7 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.42 0.688 . . . . 71.1 110.291 175.159 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -66.19 84.25 0.09 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.064 0.546 . . . . 65.31 111.059 177.338 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 59.4 t60 -78.24 86.57 4.34 Favored 'General case' 0 C--O 1.244 0.795 0 N-CA-C 106.747 -1.575 . . . . 61.33 106.747 168.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 -67.65 133.0 48.58 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 115.374 -0.83 . . . . 70.21 109.251 -178.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 11.5 m170 -65.48 -34.83 79.19 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.144 0.978 . . . . 74.25 111.506 -168.458 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 48.4 m80 55.38 77.77 0.21 Allowed 'General case' 0 N--CA 1.478 0.931 0 O-C-N 124.281 0.988 . . . . 44.53 110.728 178.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -131.36 155.08 47.86 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.956 -0.566 . . . . 74.21 109.933 -175.342 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 28.4 p-80 . . . . . 0 C--O 1.25 1.105 0 C-N-CA 123.838 0.855 . . . . 45.51 110.314 -177.786 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 mpt? . . . . . 0 N--CA 1.486 1.334 0 N-CA-C 109.435 -0.58 . . . . 72.42 109.435 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -69.19 -30.5 24.84 Favored 'Trans proline' 0 C--N 1.381 2.269 0 C-N-CA 123.138 2.559 . . . . 75.03 113.675 -175.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.45 ' O ' ' HG2' ' A' ' 7' ' ' GLU . 49.0 m 62.3 21.94 12.85 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.846 1.259 . . . . 62.11 112.609 -175.507 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -57.89 -52.37 65.76 Favored 'General case' 0 C--N 1.359 1.021 0 C-N-CA 123.32 0.648 . . . . 75.13 111.526 -174.498 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -60.13 -42.62 95.19 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 115.356 -0.838 . . . . 72.45 110.715 -178.605 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -59.39 -33.94 71.83 Favored 'General case' 0 C--N 1.349 0.586 0 C-N-CA 124.422 1.089 . . . . 71.12 111.428 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.537 ' O ' HG23 ' A' ' 11' ' ' VAL . 6.4 mm-40 -58.03 -55.53 33.7 Favored 'General case' 0 C--N 1.347 0.475 0 O-C-N 123.634 0.584 . . . . 72.31 110.13 176.772 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -33.37 75.81 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 123.099 0.25 . . . . 62.23 111.309 179.775 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 20.5 mtp180 -65.16 -33.74 76.72 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 122.871 0.468 . . . . 74.42 110.786 178.403 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.423 ' O ' HG23 ' A' ' 14' ' ' VAL . 48.3 mt-30 -68.62 -49.63 57.74 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.362 0.665 . . . . 71.42 109.694 171.643 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.566 HG13 ' HB ' ' A' ' 59' ' ' VAL . 89.9 t -64.16 -46.3 93.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 123.543 0.737 . . . . 62.13 112.562 -171.057 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.475 ' HD3' HG21 ' A' ' 33' ' ' VAL . 50.5 mtmt -64.97 -36.04 83.13 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.364 0.666 . . . . 73.5 110.715 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.565 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 59.3 tt0 -66.43 -55.63 14.83 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.022 -0.99 . . . . 73.12 109.661 177.517 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.504 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 75.5 t -52.9 -43.16 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 123.439 0.695 . . . . 72.23 110.086 177.033 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.87 -45.06 91.05 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-N 115.065 -0.97 . . . . 75.34 111.787 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.414 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 19.6 ptmt -74.48 -28.47 61.03 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.259 -0.428 . . . . 60.12 110.873 -178.776 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 19.2 mm-40 -65.83 -35.78 81.63 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 123.43 0.456 . . . . 73.24 110.144 176.911 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.607 ' HG3' HG21 ' A' ' 68' ' ' VAL . 28.6 mmmt -73.37 -31.0 63.67 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 115.564 -0.744 . . . . 71.52 110.934 178.321 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.829 ' HB3' HD12 ' A' ' 46' ' ' LEU . 26.6 mt -74.42 -26.68 60.22 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.589 -0.732 . . . . 73.24 111.136 172.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 88.3 mt -77.85 -18.94 55.72 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.24 0.616 . . . . 55.22 110.576 172.788 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -69.79 -38.38 76.63 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.966 0.506 . . . . 74.2 110.515 170.288 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -76.38 -35.44 58.64 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 115.649 -0.705 . . . . 74.23 110.569 176.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 37.9 t -158.48 96.1 1.84 Allowed Pre-proline 0 CA--C 1.552 1.057 0 C-N-CA 123.259 0.624 . . . . 60.22 110.168 -176.554 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -77.96 -15.57 14.77 Favored 'Trans proline' 0 C--N 1.38 2.203 0 C-N-CA 123.057 2.505 . . . . 62.33 113.262 -177.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -88.84 -20.65 24.37 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.871 0.868 . . . . 63.44 111.422 -174.329 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 83.6 p -82.36 158.71 23.26 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.381 0.672 . . . . 74.12 112.744 -172.295 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -81.06 120.79 25.26 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.624 -0.717 . . . . 74.25 109.476 167.729 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 39.6 t -110.52 113.91 45.58 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 N-CA-C 108.254 -1.017 . . . . 74.21 108.254 172.508 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 56.1 tp60 -108.99 145.51 35.4 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.223 1.009 . . . . 73.35 108.743 177.112 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.2 p -71.26 127.78 33.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.951 0 N-CA-C 109.457 -0.572 . . . . 73.03 109.457 172.154 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.4 tpt180 -95.54 -62.11 1.35 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 122.657 0.383 . . . . 73.52 110.076 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -151.97 161.44 42.63 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.146 0.979 . . . . 71.4 109.733 -177.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.475 HG21 ' HD3' ' A' ' 12' ' ' LYS . 88.7 t -137.86 119.09 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 C-N-CA 123.911 0.885 . . . . 71.02 109.841 -176.906 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 21.1 mp0 -120.74 112.65 19.11 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.108 0.963 . . . . 71.13 109.611 -178.705 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.548 ' HG2' HG12 ' A' ' 40' ' ' ILE . 12.6 tmtt? -83.18 105.17 13.94 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 108.112 -1.069 . . . . 71.43 108.112 178.329 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -117.45 93.32 4.12 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.725 0.81 . . . . 71.51 110.167 -173.166 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 74.53 -95.68 0.89 Allowed Glycine 0 C--N 1.346 1.102 0 CA-C-N 116.193 -0.458 . . . . 54.53 112.432 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -118.68 -17.82 9.15 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.584 0.753 . . . . 64.02 109.583 172.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.466 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 11.9 m -93.38 106.03 18.04 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.192 0.997 . . . . 74.01 110.353 -177.348 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.554 HD12 HG21 ' A' ' 11' ' ' VAL . 52.7 mt -80.98 108.29 14.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 N-CA-C 108.968 -0.753 . . . . 64.43 108.968 170.852 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.546 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 80.8 mtt180 -80.82 100.69 8.94 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.21 -0.905 . . . . 75.13 109.076 174.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 35.9 t -92.38 111.12 23.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 108.356 -0.979 . . . . 62.44 108.356 173.305 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -77.84 126.02 30.22 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 108.801 -0.814 . . . . 75.12 108.801 167.139 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -129.78 156.32 44.52 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 108.941 -0.763 . . . . 65.34 108.941 174.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -116.95 106.86 13.88 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.444 1.098 . . . . 74.1 108.652 -174.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.829 HD12 ' HB3' ' A' ' 19' ' ' LEU . 6.9 tt -107.15 140.96 39.17 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 125.172 1.389 . . . . 72.35 108.532 -173.499 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.487 ' HA ' ' HA ' ' A' ' 52' ' ' LYS . 29.9 mtm180 -102.09 95.33 6.27 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 109.49 -0.559 . . . . 72.31 109.49 178.71 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 7.1 m -84.52 100.75 11.57 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.497 0.719 . . . . 71.24 110.269 -177.371 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 61.1 t30 67.74 18.47 9.78 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 124.156 0.982 . . . . 72.13 111.456 172.678 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 99.9 -12.38 60.79 Favored Glycine 0 C--N 1.348 1.245 0 CA-C-N 116.283 -0.417 . . . . 75.21 112.863 -175.377 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 27.4 mmmt -91.06 121.29 32.73 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 108.567 -0.901 . . . . 75.22 108.567 167.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 47' ' ' ARG . 39.1 ttpt -99.38 121.53 41.24 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 109.56 -0.533 . . . . 61.22 109.56 -174.414 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -125.3 149.37 48.13 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 123.647 0.779 . . . . 52.55 110.86 -174.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -90.04 118.75 29.83 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.407 -0.815 . . . . 75.14 109.894 176.791 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -109.14 167.22 10.26 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.929 0.892 . . . . 65.35 109.506 173.839 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 42.7 m -144.62 105.08 4.11 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 108.538 -0.912 . . . . 75.22 108.538 177.342 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 42.4 t -92.71 104.98 16.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.621 0 N-CA-C 108.234 -1.024 . . . . 72.11 108.234 179.045 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.546 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 32.1 mt-10 -78.35 106.57 10.37 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 113.88 -1.509 . . . . 73.43 108.58 179.273 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.566 ' HB ' HG13 ' A' ' 11' ' ' VAL . 47.0 t -115.3 113.19 42.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 C-N-CA 123.684 0.794 . . . . 74.11 109.518 -176.896 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.534 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 32.2 tt0 -102.93 149.37 24.59 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.884 0.874 . . . . 62.13 110.483 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -67.97 129.98 41.58 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.112 0.565 . . . . 63.35 111.05 179.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 56.8 tp60 -119.05 79.86 1.46 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.88 0.872 . . . . 75.12 109.005 175.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 70.46 -100.75 0.83 Allowed Glycine 0 CA--C 1.531 1.065 0 CA-C-N 115.671 -0.695 . . . . 73.13 112.514 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -99.13 -28.0 13.56 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.844 0.857 . . . . 71.13 110.667 -179.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.9 t -100.82 172.13 7.25 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.522 0.729 . . . . 52.21 110.462 -178.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 94.3 m95 -107.52 151.52 25.47 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.485 0.714 . . . . 72.43 109.23 173.231 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 14.7 t -137.46 149.09 46.58 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.854 0.462 . . . . 64.43 110.631 -179.18 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.607 HG21 ' HG3' ' A' ' 18' ' ' LYS . 67.2 t -92.46 111.34 24.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 C-N-CA 123.671 0.788 . . . . 72.13 109.639 -175.661 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.534 ' HD3' ' HB3' ' A' ' 60' ' ' GLU . 30.7 mmmt -69.85 -57.84 4.59 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.751 0.82 . . . . 75.44 110.42 177.247 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.0 tpt180 -160.39 135.93 8.16 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.934 -0.575 . . . . 74.43 111.222 -178.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.58 HD11 ' HB3' ' A' ' 18' ' ' LYS . 56.8 mt -89.11 103.84 14.37 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 N-CA-C 107.388 -1.338 . . . . 74.32 107.388 164.226 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 86.0 m -99.89 114.68 28.07 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.488 0.715 . . . . 53.33 109.558 178.683 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 65.9 ttt180 -72.77 144.9 47.4 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 108.885 -0.783 . . . . 74.23 108.885 169.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 12.2 t -68.46 141.26 55.68 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 108.782 -0.821 . . . . 63.43 108.782 171.566 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 24.7 t -69.13 100.28 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 N-CA-C 108.643 -0.873 . . . . 71.03 108.643 -176.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -69.99 -57.64 6.85 Favored Glycine 0 C--N 1.347 1.158 0 N-CA-C 111.373 -0.691 . . . . 51.42 111.373 177.474 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 70.3 m -154.77 157.96 38.77 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 124.067 0.947 . . . . 74.23 109.421 173.565 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -155.58 171.22 20.31 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.21 1.004 . . . . 70.04 108.86 175.626 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -137.23 142.58 42.05 Favored 'General case' 0 C--O 1.242 0.684 0 C-N-CA 123.453 0.701 . . . . 64.02 109.474 -178.828 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 14.8 p-80 -76.46 166.51 23.32 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 109.796 -0.446 . . . . 74.51 109.796 177.137 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -80.09 140.07 36.61 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 109.296 -0.631 . . . . 63.12 109.296 172.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 34.1 p80 -61.07 -18.07 55.92 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 124.131 0.972 . . . . 74.5 112.834 -171.22 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 19.8 t-80 -129.56 103.4 6.85 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 108.532 -0.914 . . . . 74.41 108.532 176.735 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 44.5 t60 -129.54 103.04 6.65 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 122.824 0.45 . . . . 72.11 110.08 179.691 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 76.7 t60 . . . . . 0 C--O 1.251 1.182 0 N-CA-C 107.808 -1.182 . . . . 70.41 107.808 169.229 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.567 ' HA ' ' HD3' ' A' ' 9' ' ' ARG . 34.0 tt0 . . . . . 0 N--CA 1.47 0.555 0 N-CA-C 110.816 -0.068 . . . . 75.24 110.816 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.46 ' O ' HG23 ' A' ' 11' ' ' VAL . 30.2 mm-40 -64.83 -38.2 90.19 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 119.316 -0.373 . . . . 55.21 110.819 178.598 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -59.78 -45.94 90.74 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 109.503 -0.555 . . . . 65.21 109.503 174.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.567 ' HD3' ' HA ' ' A' ' 6' ' ' GLU . 74.4 mtp180 -54.36 -42.12 69.94 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 124.144 0.902 . . . . 70.21 111.082 -178.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.408 HE21 ' HA ' ' A' ' 7' ' ' GLU . 48.0 mt-30 -70.84 -52.62 19.19 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.754 0.821 . . . . 74.04 111.306 -179.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.68 HG21 HD12 ' A' ' 40' ' ' ILE . 96.3 t -64.79 -44.99 96.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 124.015 0.926 . . . . 74.12 112.15 -171.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.446 ' HD2' HG11 ' A' ' 30' ' ' VAL . 47.4 mtmt -68.28 -31.63 71.23 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 123.77 0.669 . . . . 64.52 110.704 -179.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.479 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 8.9 tt0 -69.51 -46.35 66.76 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 123.753 0.658 . . . . 71.24 110.033 176.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.487 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 68.8 t -58.67 -45.24 90.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 123.032 0.533 . . . . 61.1 109.631 175.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.508 ' HB1' HD11 ' A' ' 44' ' ' LEU . . . -60.61 -48.43 81.8 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.614 1.165 . . . . 71.02 111.741 -176.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.41 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 20.8 ptmt -67.74 -42.56 81.67 Favored 'General case' 0 C--N 1.351 0.639 0 O-C-N 123.63 0.581 . . . . 75.21 110.47 -178.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 63.3 mm-40 -63.64 -34.67 78.37 Favored 'General case' 0 C--N 1.357 0.932 0 O-C-N 123.62 0.575 . . . . 75.14 111.023 -177.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.495 ' HB3' HD11 ' A' ' 71' ' ' ILE . 65.9 mmtt -64.05 -40.93 97.38 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 123.654 0.596 . . . . 72.44 111.067 176.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.564 HD12 HG11 ' A' ' 28' ' ' VAL . 64.7 mt -70.41 -29.71 66.4 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 116.088 -0.506 . . . . 53.55 111.288 176.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 89.7 mt -77.65 -23.67 49.65 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.835 0.854 . . . . 63.32 110.556 175.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -74.04 -39.51 63.48 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.43 0.692 . . . . 75.35 109.543 172.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -73.38 -31.12 63.73 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 115.784 -0.643 . . . . 73.14 111.426 178.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.8 t -153.65 87.97 3.69 Favored Pre-proline 0 CA--C 1.56 1.362 0 C-N-CA 122.496 0.318 . . . . 52.11 110.307 -176.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -68.03 -17.13 45.96 Favored 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 123.658 2.905 . . . . 64.22 114.812 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -79.81 -17.46 53.29 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-O 121.03 0.443 . . . . 64.33 111.062 178.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 37.1 m -91.65 147.98 22.6 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.683 0.793 . . . . 73.41 111.443 -177.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -109.39 118.78 37.56 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 108.655 -0.868 . . . . 73.12 108.655 172.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.564 HG11 HD12 ' A' ' 19' ' ' LEU . 36.6 t -100.26 144.05 13.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 C-N-CA 124.02 0.928 . . . . 74.14 110.265 -175.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -132.58 147.96 52.36 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.342 1.057 . . . . 70.35 108.488 172.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.446 HG11 ' HD2' ' A' ' 12' ' ' LYS . 57.6 t -67.16 137.04 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.125 0.57 . . . . 74.33 109.975 177.01 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.8 tpt85 -115.7 -39.34 3.53 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.374 0.269 . . . . 73.41 110.965 -173.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.591 ' HB3' ' HB2' ' A' ' 43' ' ' GLU . 0.1 OUTLIER -167.8 144.46 4.17 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 108.551 -0.907 . . . . 54.3 108.551 -174.208 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.544 HG22 HG13 ' A' ' 42' ' ' VAL . 89.8 t -135.08 139.29 47.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 N-CA-C 108.838 -0.801 . . . . 65.22 108.838 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -135.35 113.69 11.47 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.902 0.881 . . . . 73.21 110.711 177.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.504 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 23.9 tptm -81.31 107.7 14.31 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 108.65 -0.871 . . . . 71.33 108.65 172.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -121.93 81.96 1.89 Allowed 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 108.681 -0.859 . . . . 71.24 108.681 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.504 ' O ' ' HE2' ' A' ' 35' ' ' LYS . . . 63.91 -125.65 32.98 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 111.521 -0.632 . . . . 44.12 111.521 -173.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -70.91 -30.47 66.81 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-N 117.524 0.662 . . . . 74.45 111.2 174.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 24.7 m -94.81 110.21 22.1 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 123.245 0.618 . . . . 73.43 111.798 -169.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.68 HD12 HG21 ' A' ' 11' ' ' VAL . 41.1 mt -95.57 113.5 30.1 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 123.799 0.84 . . . . 73.2 110.479 174.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 24.8 mtp-105 -87.88 101.56 13.85 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.286 0.634 . . . . 65.3 109.295 173.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.544 HG13 HG22 ' A' ' 33' ' ' VAL . 48.9 t -97.85 108.36 21.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 N-CA-C 108.763 -0.829 . . . . 73.41 108.763 176.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.591 ' HB2' ' HB3' ' A' ' 32' ' ' ARG . 51.9 mp0 -75.0 129.29 37.39 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 108.867 -0.79 . . . . 71.12 108.867 165.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.508 HD11 ' HB1' ' A' ' 15' ' ' ALA . 3.5 mp -122.72 168.29 12.4 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.878 -0.786 . . . . 72.14 108.878 172.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -126.41 108.63 11.39 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.297 -1.001 . . . . 74.4 108.297 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.416 HD12 ' HB3' ' A' ' 19' ' ' LEU . 6.8 tt -95.92 119.32 34.2 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.377 1.071 . . . . 75.41 108.112 -177.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 84.9 mtm180 . . . . . 0 N--CA 1.479 0.989 0 C-N-CA 123.498 0.719 . . . . 74.23 109.914 -174.929 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt . . . . . 0 CA--C 1.534 0.352 0 N-CA-C 107.223 -1.399 . . . . 75.42 107.223 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -104.48 114.82 29.31 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.222 0.609 . . . . 70.24 109.556 -174.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -75.39 117.98 17.78 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.645 -0.872 . . . . 65.14 108.645 171.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -105.92 170.46 7.89 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.646 0.778 . . . . 74.04 109.716 177.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 26.8 m -145.09 102.16 3.71 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 108.028 -1.101 . . . . 72.44 108.028 173.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.42 HG11 ' HA ' ' A' ' 15' ' ' ALA . 61.1 t -93.0 102.92 14.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 N-CA-C 107.019 -1.474 . . . . 71.13 107.019 178.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -89.19 105.3 17.7 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 114.298 -1.319 . . . . 70.42 108.14 -177.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 45.4 t -100.04 152.26 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 125.041 1.337 . . . . 73.54 109.52 -176.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -130.0 144.99 51.63 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.133 0.973 . . . . 70.3 110.207 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.8 tpt180 -81.33 113.04 19.16 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.774 0.83 . . . . 75.31 109.566 175.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 -120.42 100.63 7.27 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 107.998 -1.112 . . . . 72.25 107.998 170.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 72.49 -112.19 3.89 Favored Glycine 0 C--N 1.348 1.2 0 N-CA-C 111.368 -0.693 . . . . 45.25 111.368 -175.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -106.54 -16.13 14.61 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.571 0.748 . . . . 73.5 110.572 174.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 42.2 p -93.37 149.23 21.39 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 122.993 0.517 . . . . 75.35 111.166 -172.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -103.25 116.22 32.04 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.226 1.01 . . . . 75.05 109.905 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.1 t -108.49 145.22 35.04 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.762 0.825 . . . . 54.45 110.435 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.47 HG21 ' HG3' ' A' ' 18' ' ' LYS . 88.7 t -86.23 113.02 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 O-C-N 121.856 -0.527 . . . . 71.13 109.908 179.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.5 mmmp? -66.1 -47.47 74.09 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.913 0.885 . . . . 55.31 110.603 173.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -161.95 154.29 19.59 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.501 -0.772 . . . . 71.33 110.75 -178.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.495 HD11 ' HB3' ' A' ' 18' ' ' LYS . 80.3 mt -113.57 107.24 22.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 107.119 -1.438 . . . . 50.33 107.119 166.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 27.6 m -92.28 144.18 25.65 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.662 0.785 . . . . 72.32 109.063 178.112 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -116.18 148.48 40.32 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 107.21 -1.404 . . . . 74.51 107.21 170.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.1 t . . . . . 0 CA--C 1.549 0.929 0 C-N-CA 123.452 0.701 . . . . 32.34 109.902 174.355 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 . . . . . 0 N--CA 1.474 0.743 0 N-CA-C 110.662 -0.125 . . . . 73.41 110.662 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.552 ' O ' HG23 ' A' ' 11' ' ' VAL . 67.8 mm-40 -59.06 -47.31 85.69 Favored 'General case' 0 C--N 1.356 0.875 0 CA-C-O 118.745 -0.645 . . . . 72.12 110.696 -178.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.72 -35.46 72.71 Favored 'General case' 0 C--N 1.364 1.199 0 O-C-N 123.671 0.607 . . . . 43.11 111.022 177.279 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 20.9 mtm180 -65.55 -32.82 74.62 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 122.627 0.371 . . . . 73.42 110.902 178.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.409 ' O ' HG23 ' A' ' 14' ' ' VAL . 41.6 mt-30 -74.36 -38.48 63.19 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 122.99 0.516 . . . . 75.15 110.555 174.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.644 HG21 HD12 ' A' ' 40' ' ' ILE . 58.5 t -70.11 -44.29 78.28 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 C-N-CA 123.493 0.717 . . . . 62.03 111.288 -176.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.467 ' HD3' HG21 ' A' ' 33' ' ' VAL . 45.7 mtmt -63.03 -37.35 86.82 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.911 0.884 . . . . 62.11 110.02 177.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.452 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.3 tt0 -63.28 -55.65 22.98 Favored 'General case' 0 C--N 1.353 0.729 0 O-C-N 124.408 1.067 . . . . 71.14 110.072 177.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.527 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 95.8 t -55.84 -44.24 76.99 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 O-C-N 123.515 0.51 . . . . 61.12 109.941 178.468 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.435 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -60.24 -45.78 92.07 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 124.561 1.144 . . . . 62.24 112.156 -177.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -74.47 -31.98 62.42 Favored 'General case' 0 C--N 1.349 0.582 0 CA-C-N 116.02 -0.536 . . . . 62.45 110.68 -177.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 7.3 mm-40 -64.81 -38.39 90.82 Favored 'General case' 0 C--N 1.352 0.692 0 O-C-N 123.807 0.692 . . . . 75.31 110.014 176.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.527 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 29.0 mmmt -58.94 -49.89 76.14 Favored 'General case' 0 C--N 1.362 1.124 0 O-C-N 123.72 0.637 . . . . 72.52 110.617 176.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.645 ' HB3' HD12 ' A' ' 46' ' ' LEU . 53.1 mt -66.29 -29.26 69.44 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.227 -0.897 . . . . 63.45 112.194 -179.101 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.9 mt -78.86 -27.5 44.08 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.219 0.607 . . . . 54.34 111.078 176.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.445 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 52.7 mt-10 -70.94 -42.87 69.25 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 109.719 -0.474 . . . . 63.43 109.719 174.282 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.44 ' NE2' HD23 ' A' ' 19' ' ' LEU . 47.4 mt-30 -68.64 -41.85 78.83 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 115.168 -0.924 . . . . 74.23 111.001 178.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.2 t -145.58 91.51 5.72 Favored Pre-proline 0 CA--C 1.552 1.054 0 CA-C-N 115.662 -0.699 . . . . 72.12 109.453 -177.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -79.63 -2.85 12.52 Favored 'Trans proline' 0 C--N 1.378 2.102 0 C-N-CA 122.927 2.418 . . . . 55.24 112.15 174.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -95.26 13.93 23.96 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.399 1.08 . . . . 74.32 110.673 -178.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 60.1 p -135.21 148.87 49.77 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.048 0.539 . . . . 64.24 110.871 -175.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.402 ' HE2' ' HA ' ' A' ' 27' ' ' LYS . 11.1 mmpt? -90.3 114.63 26.73 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-O 121.256 0.551 . . . . 74.44 109.925 175.215 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 87.5 t -99.86 124.69 53.43 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 CA-C-N 114.29 -1.323 . . . . 72.23 109.252 -178.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -112.85 167.06 10.81 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.225 1.41 . . . . 63.24 108.157 174.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.41 HG21 ' HB3' ' A' ' 12' ' ' LYS . 87.6 t -104.96 110.92 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 N-CA-C 107.929 -1.137 . . . . 50.33 107.929 169.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -81.89 -43.82 17.65 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 122.767 0.427 . . . . 62.13 111.379 -171.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -162.78 146.21 11.14 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 108.168 -1.049 . . . . 70.23 108.168 -176.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.544 HG13 HG22 ' A' ' 42' ' ' VAL . 40.0 t -118.34 141.22 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 N-CA-C 108.892 -0.781 . . . . 53.14 108.892 177.175 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -135.83 112.74 10.28 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 122.988 0.515 . . . . 73.02 110.241 177.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.413 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 3.2 tmtp? -86.11 117.48 24.97 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 108.349 -0.982 . . . . 74.23 108.349 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -129.23 75.89 1.68 Allowed 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.464 0.706 . . . . 70.4 110.083 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.413 ' O ' ' HE2' ' A' ' 35' ' ' LYS . . . 67.27 -96.99 0.35 Allowed Glycine 0 C--N 1.35 1.335 0 CA-C-N 115.274 -0.875 . . . . 74.31 113.971 173.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.705 ' HB3' ' HG3' ' A' ' 60' ' ' GLU . 16.7 m120 -80.24 -52.58 7.56 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 109.254 -0.647 . . . . 53.12 109.254 173.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 19.8 m -94.84 110.3 22.19 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 114.919 -1.037 . . . . 64.43 110.601 -168.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.644 HD12 HG21 ' A' ' 11' ' ' VAL . 41.9 mt -87.86 107.99 17.99 Favored 'Isoleucine or valine' 0 C--O 1.24 0.568 0 N-CA-C 108.541 -0.911 . . . . 71.52 108.541 169.563 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.56 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 86.8 mtt180 -82.97 96.54 8.35 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 109.0 -0.741 . . . . 61.1 109.0 174.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.544 HG22 HG13 ' A' ' 33' ' ' VAL . 40.7 t -88.29 114.11 26.31 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 107.832 -1.173 . . . . 74.05 107.832 174.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -85.94 107.16 17.6 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.907 0.883 . . . . 74.35 109.411 174.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.2 mp -99.43 170.51 8.57 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.689 0.796 . . . . 74.03 110.761 178.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -130.19 104.04 7.07 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.98 0.912 . . . . 62.45 109.37 -177.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.645 HD12 ' HB3' ' A' ' 19' ' ' LEU . 9.6 tt -104.58 143.96 32.35 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 108.432 -0.951 . . . . 74.52 108.432 -177.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 56.1 mtt85 . . . . . 0 N--CA 1.479 0.98 0 C-N-CA 122.923 0.489 . . . . 61.23 110.814 -177.198 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 33.9 ttpt . . . . . 0 CA--C 1.546 0.804 0 N-CA-C 111.734 0.272 . . . . 75.21 111.734 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -118.67 113.01 20.54 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 107.826 -1.176 . . . . 73.43 107.826 170.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -81.21 126.07 31.07 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.241 0.616 . . . . 73.41 110.031 177.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -113.06 118.73 35.6 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.198 0.599 . . . . 70.51 109.706 178.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 30.7 m -86.33 102.7 14.24 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.978 0.911 . . . . 63.13 109.093 174.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.465 HG13 HG12 ' A' ' 71' ' ' ILE . 56.0 t -91.54 105.91 17.06 Favored 'Isoleucine or valine' 0 C--O 1.243 0.733 0 N-CA-C 108.633 -0.877 . . . . 72.41 108.633 179.137 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.56 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 24.7 mt-10 -83.84 102.04 12.07 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 125.237 1.415 . . . . 52.32 108.985 -178.015 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.552 HG22 HG22 ' A' ' 68' ' ' VAL . 18.1 t -110.43 123.59 66.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 123.394 0.678 . . . . 70.11 109.373 -177.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.705 ' HG3' ' HB3' ' A' ' 38' ' ' ASN . 39.7 tt0 -102.97 142.97 33.17 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.123 0.969 . . . . 75.42 110.723 -175.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -79.96 111.72 16.57 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 123.584 0.754 . . . . 72.44 109.103 171.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 15.6 mm-40 -116.15 99.26 7.11 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 108.235 -1.024 . . . . 74.15 108.235 171.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.45 -106.07 1.69 Allowed Glycine 0 C--N 1.345 1.053 0 N-CA-C 111.115 -0.794 . . . . 62.44 111.115 -173.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -112.65 -17.57 12.56 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.014 0.926 . . . . 63.14 110.656 174.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 81.0 p -88.36 128.83 35.51 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 122.965 0.506 . . . . 74.45 110.279 -174.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.8 m95 -82.24 131.97 35.23 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.519 0.728 . . . . 73.51 109.287 172.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 8.8 t -132.67 121.12 22.66 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 123.442 0.697 . . . . 73.2 109.785 -175.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.552 HG22 HG22 ' A' ' 59' ' ' VAL . 97.7 t -74.32 104.02 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 123.605 0.762 . . . . 65.52 110.075 -179.244 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -70.0 -50.75 38.43 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.592 0.757 . . . . 74.52 110.754 -177.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 21.4 tpt180 -158.75 147.34 18.5 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.508 -0.769 . . . . 70.24 110.14 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.465 HG12 HG13 ' A' ' 57' ' ' VAL . 65.8 mt -110.55 105.73 19.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 N-CA-C 107.909 -1.145 . . . . 44.44 107.909 172.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 59.9 m -98.93 107.12 19.48 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.786 0.834 . . . . 60.02 110.302 -178.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 30.6 ttp180 -75.01 151.01 38.79 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.516 0.726 . . . . 72.33 110.439 175.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 15.1 t . . . . . 0 CA--C 1.549 0.923 0 C-N-CA 123.399 0.68 . . . . 71.12 109.576 171.709 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 . . . . . 0 N--CA 1.485 1.314 0 CA-C-O 121.16 0.505 . . . . 64.5 111.442 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.56 ' O ' HG23 ' A' ' 11' ' ' VAL . 12.2 pt-20 -59.39 -37.56 78.29 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 115.651 -0.704 . . . . 64.11 110.808 176.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.596 ' HG3' HG11 ' A' ' 33' ' ' VAL . 0.3 OUTLIER -54.84 -39.13 68.26 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 123.627 0.771 . . . . 73.55 111.142 177.925 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.8 mmm180 -62.39 -42.56 99.52 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.708 0.803 . . . . 75.33 109.93 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.447 ' O ' HG23 ' A' ' 14' ' ' VAL . 45.7 mm-40 -66.84 -43.08 84.62 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 114.729 -1.123 . . . . 74.33 110.937 177.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.601 HG21 HD12 ' A' ' 40' ' ' ILE . 63.7 t -67.89 -43.22 86.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 123.854 0.862 . . . . 72.14 111.655 -174.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -63.51 -31.91 73.21 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.029 0.531 . . . . 72.41 110.488 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.438 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 8.7 tt0 -66.71 -52.95 38.74 Favored 'General case' 0 C--N 1.349 0.554 0 O-C-N 123.847 0.717 . . . . 71.1 110.165 174.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 10' ' ' GLN . 66.1 t -59.71 -30.79 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 123.624 0.77 . . . . 64.03 110.804 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.511 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -76.17 -47.12 25.34 Favored 'General case' 0 C--O 1.248 0.992 0 C-N-CA 123.977 0.911 . . . . 62.24 111.992 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -70.59 -33.64 71.29 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 116.054 -0.521 . . . . 64.42 111.514 -172.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 23.1 mm-40 -65.92 -36.99 84.9 Favored 'General case' 0 C--N 1.353 0.753 0 O-C-N 123.789 0.68 . . . . 74.2 110.887 178.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.595 ' HG3' HG21 ' A' ' 68' ' ' VAL . 68.4 mmtt -60.66 -42.89 97.94 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 123.613 0.571 . . . . 62.25 111.303 176.502 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 51.4 mt -72.45 -30.23 64.4 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 115.756 -0.656 . . . . 70.13 111.859 178.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 68.8 mt -70.34 -27.38 64.31 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.204 0.602 . . . . 75.44 111.308 174.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 50.5 mt-10 -70.12 -35.05 73.83 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 120.947 0.403 . . . . 73.31 110.479 174.177 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -83.08 -24.98 32.45 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 115.61 -0.723 . . . . 72.03 111.664 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.0 t -158.56 93.61 1.95 Allowed Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 123.448 0.699 . . . . 45.54 109.394 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_endo -82.06 -9.45 11.76 Favored 'Trans proline' 0 C--N 1.373 1.828 0 C-N-CA 123.142 2.561 . . . . 74.11 113.683 -178.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -85.82 -6.18 59.14 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.263 0.625 . . . . 61.41 111.447 -178.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 64.6 p -114.37 140.54 48.57 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.198 0.999 . . . . 74.1 111.078 -175.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -80.15 127.61 32.52 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.903 -0.777 . . . . 55.5 108.903 171.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.558 HG22 HD12 ' A' ' 46' ' ' LEU . 39.6 t -98.71 112.67 31.4 Favored 'Isoleucine or valine' 0 C--O 1.239 0.532 0 O-C-N 123.535 0.522 . . . . 65.52 109.669 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -99.13 172.98 7.04 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.618 0.767 . . . . 71.42 109.394 175.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.7 p -98.3 132.87 42.47 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 N-CA-C 108.923 -0.769 . . . . 65.41 108.923 171.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.8 tpt180 -88.95 -47.44 8.14 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.399 0.68 . . . . 73.25 109.304 173.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.6 mtt180 -165.02 157.78 16.24 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.319 1.048 . . . . 64.13 109.755 175.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.596 HG11 ' HG3' ' A' ' 8' ' ' LYS . 73.0 t -116.49 110.27 30.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 N-CA-C 108.692 -0.855 . . . . 63.51 108.692 175.353 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -100.99 109.8 21.76 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.172 0.589 . . . . 75.13 109.435 -177.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.3 mmtt -79.69 136.29 36.75 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.915 0.886 . . . . 74.44 109.475 178.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -150.6 67.07 0.94 Allowed 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 107.928 -1.138 . . . . 73.13 107.928 -178.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 67.86 -135.24 30.28 Favored Glycine 0 C--N 1.349 1.277 0 CA-C-N 115.293 -0.867 . . . . 75.52 111.857 -173.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -76.45 -1.14 25.64 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.05 0.54 . . . . 33.32 111.856 176.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 55.1 m -99.84 141.66 32.36 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.462 0.705 . . . . 71.12 109.161 169.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.601 HD12 HG21 ' A' ' 11' ' ' VAL . 59.9 mt -129.79 117.4 41.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 C-N-CA 123.477 0.711 . . . . 53.32 109.222 171.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.424 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 9.8 mtp180 -81.91 97.9 8.28 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 108.684 -0.858 . . . . 74.22 108.684 169.031 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.6 t -80.71 114.19 21.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 N-CA-C 107.973 -1.121 . . . . 74.33 107.973 174.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -86.16 117.57 25.07 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 106.632 -1.618 . . . . 54.43 106.632 169.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.0 mp -111.92 169.84 8.56 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.054 0.454 . . . . 61.2 110.117 -179.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -141.58 107.64 5.19 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.696 0.76 . . . . 61.14 109.16 179.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.558 HD12 HG22 ' A' ' 28' ' ' VAL . 3.0 tt -113.21 135.52 53.73 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.522 1.529 . . . . 72.31 108.492 -173.131 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 66.5 mtp180 . . . . . 0 N--CA 1.486 1.358 0 CA-C-N 117.87 0.305 . . . . 72.21 111.463 -178.746 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt . . . . . 0 N--CA 1.471 0.596 0 CA-C-O 121.546 0.688 . . . . 71.52 109.655 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -108.62 125.55 51.99 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 115.332 -0.849 . . . . 75.33 109.872 -175.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -78.72 146.06 34.14 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.199 0.523 . . . . 63.02 109.709 171.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -132.71 171.12 14.29 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.666 0.786 . . . . 74.1 109.507 177.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.682 ' HB ' ' HB ' ' A' ' 72' ' ' THR . 79.3 m -142.23 104.22 4.41 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 108.174 -1.047 . . . . 55.32 108.174 177.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.511 HG11 ' HA ' ' A' ' 15' ' ' ALA . 99.1 t -99.54 104.82 16.56 Favored 'Isoleucine or valine' 0 C--O 1.239 0.545 0 N-CA-C 107.726 -1.213 . . . . 72.14 107.726 174.281 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.424 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 31.5 mt-10 -82.59 100.21 10.01 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 114.007 -1.451 . . . . 61.52 108.618 -177.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.1 t -100.95 151.17 5.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 124.19 0.996 . . . . 74.42 109.132 -177.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -145.31 135.62 24.04 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 108.753 -0.832 . . . . 71.21 108.753 -175.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 31.1 ttp180 -80.29 133.27 35.95 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.152 0.581 . . . . 73.13 111.998 -172.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 64.3 mm-40 -121.08 109.24 14.8 Favored 'General case' 0 C--O 1.242 0.697 0 N-CA-C 107.515 -1.291 . . . . 73.04 107.515 175.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 67.88 -106.13 1.61 Allowed Glycine 0 C--N 1.345 1.029 0 N-CA-C 110.719 -0.953 . . . . 73.33 110.719 -171.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 54.3 t30 -110.41 -27.28 9.11 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.804 0.842 . . . . 50.44 110.022 172.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 33.9 p -77.75 172.52 13.29 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.163 0.585 . . . . 73.13 110.675 -177.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 89.0 m95 -125.76 146.68 49.67 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.376 0.67 . . . . 71.14 110.371 -175.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 6.1 t -137.75 144.07 41.48 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 122.892 0.477 . . . . 64.15 110.092 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.595 HG21 ' HG3' ' A' ' 18' ' ' LYS . 76.3 t -82.96 118.67 31.04 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 123.072 0.549 . . . . 61.21 109.86 177.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -88.62 -30.99 18.8 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 116.096 -0.502 . . . . 75.4 111.509 177.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 65.5 ttt-85 -158.66 137.17 10.94 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 120.527 0.204 . . . . 63.22 111.292 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 73.3 mt -103.02 131.18 51.88 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 N-CA-C 107.975 -1.121 . . . . 64.15 107.975 168.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.682 ' HB ' ' HB ' ' A' ' 56' ' ' THR . 27.8 m -128.1 150.2 50.07 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.203 1.001 . . . . 43.13 108.976 -177.455 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 27.4 ttp180 -126.41 145.37 50.49 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.079 0.952 . . . . 75.34 108.634 175.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.7 t . . . . . 0 CA--C 1.546 0.808 0 CA-C-O 121.111 0.481 . . . . 54.21 110.053 177.088 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 . . . . . 0 CA--C 1.53 0.2 0 N-CA-C 111.495 0.183 . . . . 63.21 111.495 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.554 ' O ' HG23 ' A' ' 11' ' ' VAL . 7.5 mm-40 -52.09 -52.41 51.46 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 124.295 0.997 . . . . 64.2 110.568 178.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.1 -43.2 96.1 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.17 -0.923 . . . . 74.32 109.811 -177.293 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 25.3 mtm180 -59.78 -35.12 73.99 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.6 0.76 . . . . 71.35 111.708 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.468 ' O ' HG23 ' A' ' 14' ' ' VAL . 46.8 mt-30 -75.12 -55.1 6.07 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.406 0.682 . . . . 72.21 110.511 179.085 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.586 HG13 ' HB ' ' A' ' 59' ' ' VAL . 42.8 t -62.73 -46.01 97.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 123.726 0.81 . . . . 74.23 111.766 -170.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -66.42 -33.4 75.63 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.135 0.574 . . . . 24.51 110.882 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -70.76 -44.34 66.94 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 123.603 0.564 . . . . 64.13 110.214 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.488 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 88.9 t -58.05 -50.35 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 N-CA-C 109.051 -0.722 . . . . 74.41 109.051 175.202 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.494 ' HB1' HD11 ' A' ' 44' ' ' LEU . . . -58.53 -45.91 87.89 Favored 'General case' 0 C--O 1.244 0.786 0 CA-C-N 114.368 -1.287 . . . . 72.41 112.292 -175.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.416 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 22.4 ptmt -69.45 -37.02 77.17 Favored 'General case' 0 C--N 1.353 0.749 0 O-C-N 123.525 0.515 . . . . 74.05 110.46 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.41 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 40.0 mt-10 -64.38 -34.03 77.23 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.319 0.647 . . . . 72.51 111.067 179.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.502 ' HG3' HG21 ' A' ' 68' ' ' VAL . 30.5 mmmt -69.87 -35.49 74.72 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.06 0.457 . . . . 64.54 110.504 178.088 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.759 ' HB3' HD12 ' A' ' 46' ' ' LEU . 41.7 mt -72.61 -23.57 60.96 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 115.257 -0.883 . . . . 74.31 111.299 173.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 96.4 mt -85.18 -17.66 36.47 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.986 0.914 . . . . 75.44 111.462 175.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 15.1 mm-40 -71.91 -44.13 64.2 Favored 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 108.467 -0.938 . . . . 72.25 108.467 169.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -78.52 -32.76 48.21 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 114.732 -1.122 . . . . 64.02 111.322 -177.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.547 ' HB2' HD11 ' A' ' 46' ' ' LEU . 49.0 m -154.83 80.9 4.38 Favored Pre-proline 0 CA--C 1.562 1.408 0 C-N-CA 123.854 0.861 . . . . 61.45 110.368 -173.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.2 -27.07 17.09 Favored 'Trans proline' 0 C--N 1.375 1.957 0 C-N-CA 122.722 2.282 . . . . 72.21 113.308 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.408 HD22 ' N ' ' A' ' 25' ' ' ASN . 0.8 OUTLIER -83.84 -9.67 58.59 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.343 0.657 . . . . 73.53 111.488 -177.566 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 38.0 m -89.34 145.98 25.0 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.274 0.63 . . . . 64.33 111.188 -177.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.424 ' HE2' ' HA ' ' A' ' 27' ' ' LYS . 0.6 OUTLIER -89.29 109.18 20.1 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.6 0.76 . . . . 71.43 109.641 -178.855 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 64.5 t -97.61 122.0 48.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 C-N-CA 124.05 0.94 . . . . 63.42 109.249 -175.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 73.6 mm-40 -101.37 148.44 25.15 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.492 1.117 . . . . 73.22 108.686 177.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 59.0 t -78.58 106.98 10.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 N-CA-C 107.68 -1.23 . . . . 64.35 107.68 166.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.7 tpt180 -82.12 -61.68 1.84 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 122.609 0.364 . . . . 73.02 110.021 -177.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -147.47 170.05 18.22 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 125.177 1.391 . . . . 62.31 109.359 179.064 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.412 HG13 HG22 ' A' ' 42' ' ' VAL . 61.4 t -135.57 114.85 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 N-CA-C 108.134 -1.062 . . . . 70.22 108.134 173.218 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -107.88 110.81 22.67 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.534 0.734 . . . . 70.31 109.219 -179.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.464 ' HG2' HG12 ' A' ' 40' ' ' ILE . 2.5 tmtp? -92.43 108.74 20.19 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 108.602 -0.888 . . . . 71.14 108.602 -176.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -121.31 83.26 2.05 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.492 0.717 . . . . 72.53 110.026 -178.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.77 -108.96 2.66 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 115.206 -0.907 . . . . 72.23 112.889 178.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -93.34 -27.51 16.73 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.334 0.653 . . . . 70.5 110.2 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 32.6 m -93.11 97.72 10.85 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 123.6 0.76 . . . . 65.52 110.489 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.464 HG12 ' HG2' ' A' ' 35' ' ' LYS . 36.0 mt -86.19 107.45 16.58 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 N-CA-C 108.549 -0.908 . . . . 73.54 108.549 173.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 52.0 mtt85 -89.0 96.66 10.82 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.395 1.078 . . . . 70.24 109.797 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.423 HG23 HG12 ' A' ' 11' ' ' VAL . 57.3 t -80.82 124.45 38.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 108.575 -0.898 . . . . 72.03 108.575 175.357 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -90.94 124.09 34.94 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 107.966 -1.124 . . . . 72.15 107.966 174.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.494 HD11 ' HB1' ' A' ' 15' ' ' ALA . 2.0 mp -128.43 150.01 50.31 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 109.156 -0.683 . . . . 74.22 109.156 -179.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -108.81 106.04 15.88 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.376 0.608 . . . . 60.44 109.567 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.759 HD12 ' HB3' ' A' ' 19' ' ' LEU . 9.3 tt -92.68 109.11 20.53 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 107.527 -1.286 . . . . 75.31 107.527 -177.032 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 . . . . . 0 CA--C 1.539 0.553 0 C-N-CA 124.371 1.068 . . . . 71.34 109.59 -175.592 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.0 tttt . . . . . 0 C--O 1.237 0.419 0 N-CA-C 106.32 -1.733 . . . . 70.45 106.32 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -114.19 141.46 47.5 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.66 0.784 . . . . 54.24 109.641 -171.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -111.96 117.0 31.51 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 108.877 -0.786 . . . . 54.15 108.877 174.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -108.1 120.6 42.8 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.65 1.18 . . . . 75.03 110.095 178.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 32.9 m -88.94 101.44 14.07 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 108.775 -0.824 . . . . 73.15 108.775 168.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.545 HG22 HG23 ' A' ' 71' ' ' ILE . 43.0 t -91.88 106.62 17.91 Favored 'Isoleucine or valine' 0 C--O 1.243 0.746 0 N-CA-C 108.554 -0.906 . . . . 54.02 108.554 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -77.38 102.91 7.02 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 114.258 -1.337 . . . . 70.23 108.831 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.586 ' HB ' HG13 ' A' ' 11' ' ' VAL . 27.0 t -111.37 130.31 65.11 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 C-N-CA 123.809 0.844 . . . . 65.31 108.893 -178.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -120.2 141.15 50.17 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.252 0.621 . . . . 74.03 110.758 -173.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -74.59 116.33 15.16 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.487 0.715 . . . . 73.31 110.492 176.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 36.1 mm-40 -117.21 107.28 14.25 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.223 1.009 . . . . 64.03 108.623 171.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 63.18 -115.24 7.75 Favored Glycine 0 C--N 1.348 1.227 0 N-CA-C 111.124 -0.79 . . . . 52.3 111.124 -172.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -91.68 -32.21 15.53 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.504 0.721 . . . . 71.32 109.934 171.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 82.0 p -82.64 173.02 12.31 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.534 0.733 . . . . 61.41 112.129 -168.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -128.66 110.92 12.64 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.141 0.976 . . . . 75.12 110.365 -174.23 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.3 t -93.39 160.65 14.72 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.332 0.653 . . . . 44.31 110.672 177.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.502 HG21 ' HG3' ' A' ' 18' ' ' LYS . 48.1 t -100.42 120.86 50.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 123.203 0.601 . . . . 54.23 109.447 174.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -83.47 -53.07 5.97 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 123.938 0.895 . . . . 75.01 110.618 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 21.5 tpp180 -165.27 144.16 6.47 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.161 0.584 . . . . 63.53 110.422 177.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.545 HG23 HG22 ' A' ' 57' ' ' VAL . 59.2 mt -103.73 105.94 19.31 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 N-CA-C 107.934 -1.136 . . . . 74.44 107.934 172.032 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 57.4 m -97.98 103.89 15.87 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.621 0.769 . . . . 72.53 109.216 -178.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 36.3 ttp180 -85.93 147.4 26.26 Favored 'General case' 0 C--O 1.243 0.724 0 N-CA-C 109.501 -0.555 . . . . 75.32 109.501 175.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 10.0 t . . . . . 0 CA--C 1.554 1.118 0 O-C-N 123.771 0.669 . . . . 72.44 110.151 171.272 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 . . . . . 0 N--CA 1.478 0.939 0 N-CA-C 111.672 0.249 . . . . 74.43 111.672 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.481 ' O ' HG23 ' A' ' 11' ' ' VAL . 44.7 mt-10 -52.4 -52.57 53.09 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 124.322 1.014 . . . . 72.41 110.448 175.609 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.451 ' O ' ' HG3' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -62.38 -42.42 99.4 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 124.545 1.153 . . . . 70.11 109.529 -175.731 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -59.58 -42.66 93.01 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.145 0.978 . . . . 75.42 110.567 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.417 ' O ' HG23 ' A' ' 14' ' ' VAL . 61.7 mt-30 -66.44 -49.79 65.53 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.218 1.007 . . . . 63.32 110.874 177.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.51 HG21 HD12 ' A' ' 40' ' ' ILE . 86.4 t -67.52 -35.27 72.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 124.012 0.925 . . . . 75.12 112.111 -170.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' A' ' 8' ' ' LYS . 53.4 mtmt -60.75 -36.36 78.72 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 122.704 0.402 . . . . 72.41 110.513 176.36 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.449 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 9.8 tt0 -71.39 -49.55 40.95 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 115.421 -0.809 . . . . 71.23 110.07 176.087 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.524 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 67.7 t -55.43 -40.25 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 123.396 0.678 . . . . 61.14 110.487 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.73 -47.64 58.67 Favored 'General case' 0 C--O 1.245 0.865 0 C-N-CA 124.603 1.161 . . . . 74.34 111.745 -176.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.401 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 22.4 ptmt -66.83 -33.92 76.67 Favored 'General case' 0 C--N 1.358 0.952 0 CA-C-N 116.134 -0.485 . . . . 72.4 110.714 -176.057 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.449 ' HG3' ' O ' ' A' ' 13' ' ' GLN . 53.0 mt-10 -61.18 -41.33 96.61 Favored 'General case' 0 C--N 1.36 1.047 0 O-C-N 124.064 0.852 . . . . 71.22 110.599 179.201 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.658 ' HG3' HG21 ' A' ' 68' ' ' VAL . 71.8 mmtt -68.25 -35.2 77.54 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 123.802 0.689 . . . . 61.44 110.825 -178.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 77.6 mt -70.08 -30.04 67.18 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.107 0.563 . . . . 73.34 111.535 173.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 95.1 mt -81.38 -16.77 51.24 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.667 0.787 . . . . 63.51 110.737 175.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -81.2 -46.1 15.36 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 109.427 -0.582 . . . . 73.3 109.427 172.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -71.85 -24.34 61.67 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.291 0.636 . . . . 73.54 111.319 178.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 t -158.01 82.83 2.83 Favored Pre-proline 0 CA--C 1.558 1.273 0 O-C-N 123.421 0.45 . . . . 64.24 110.138 -178.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -61.37 -33.57 88.63 Favored 'Trans proline' 0 C--N 1.381 2.282 0 C-N-CA 123.411 2.741 . . . . 73.52 115.01 -177.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -76.14 -18.45 59.12 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 122.815 0.446 . . . . 65.24 112.103 -175.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 58.3 m -76.64 148.68 36.75 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.381 0.672 . . . . 74.11 111.797 -177.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.512 ' HE3' ' HA ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -103.34 116.33 32.24 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.913 0.885 . . . . 72.34 109.77 174.107 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 51.1 t -99.36 141.24 17.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 CA-C-N 114.705 -1.134 . . . . 75.11 109.525 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -131.63 110.78 11.17 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 108.005 -1.109 . . . . 75.12 108.005 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.451 HG21 ' HB3' ' A' ' 12' ' ' LYS . 73.9 t -58.73 114.57 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 N-CA-C 109.434 -0.58 . . . . 73.14 109.434 178.106 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -92.29 -46.64 7.61 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 123.882 0.739 . . . . 74.1 110.756 -171.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 21.0 tpt180 -157.24 155.33 30.63 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.455 0.702 . . . . 72.23 109.951 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 89.9 t -126.42 141.46 45.83 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 124.33 1.052 . . . . 65.23 109.43 176.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 74.2 mm-40 -128.01 109.17 11.3 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 124.353 1.061 . . . . 65.04 108.931 177.447 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -92.12 110.72 22.1 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 108.084 -1.08 . . . . 71.12 108.084 178.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -122.9 90.28 3.26 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.314 0.646 . . . . 73.1 110.104 -179.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.56 -81.95 0.95 Allowed Glycine 0 C--N 1.35 1.352 0 CA-C-N 116.246 -0.433 . . . . 70.42 112.485 177.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -142.86 1.07 1.27 Allowed 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.695 1.198 . . . . 73.13 110.61 169.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 23.5 m -98.13 97.76 9.15 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.755 -0.831 . . . . 64.21 108.755 174.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.51 HD12 HG21 ' A' ' 11' ' ' VAL . 32.5 mt -92.49 107.66 19.27 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 C-N-CA 123.371 0.669 . . . . 52.31 110.067 178.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.519 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 94.3 mtt180 -87.41 105.26 17.15 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.389 1.076 . . . . 71.14 109.304 174.592 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 50.1 t -96.98 119.51 45.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 N-CA-C 109.086 -0.709 . . . . 72.41 109.086 175.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.484 ' HB3' HD21 ' A' ' 54' ' ' ASN . 7.1 mp0 -83.16 116.58 22.42 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 108.62 -0.882 . . . . 54.13 108.62 170.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.4 mp -116.23 153.64 31.51 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 109.088 -0.708 . . . . 72.04 109.088 176.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -115.76 104.23 11.46 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 124.191 0.996 . . . . 74.02 108.474 -171.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.0 tt -98.95 111.15 23.63 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 108.36 -0.978 . . . . 75.22 108.36 -173.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 57.4 mtt85 . . . . . 0 N--CA 1.474 0.757 0 C-N-CA 123.664 0.786 . . . . 74.31 110.152 -176.254 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.3 pttt . . . . . 0 N--CA 1.471 0.597 0 N-CA-C 109.669 -0.493 . . . . 75.44 109.669 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 49.8 mm-40 -127.38 119.62 26.61 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 107.89 -1.152 . . . . 62.55 107.89 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.484 HD21 ' HB3' ' A' ' 43' ' ' GLU . 8.2 t-20 -83.13 119.19 24.2 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 108.651 -0.87 . . . . 62.25 108.651 175.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -107.88 117.69 34.77 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 124.017 0.927 . . . . 72.01 109.303 177.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 59.0 m -84.43 100.43 11.32 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 107.909 -1.145 . . . . 72.25 107.909 168.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.452 HG22 HG23 ' A' ' 71' ' ' ILE . 57.6 t -91.99 103.83 14.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.447 0 N-CA-C 108.082 -1.081 . . . . 73.43 108.082 -179.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.519 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 30.1 mt-10 -79.01 102.13 8.18 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 114.57 -1.195 . . . . 73.43 108.723 -178.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.661 HG22 HG22 ' A' ' 68' ' ' VAL . 58.7 t -104.39 143.41 16.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 124.275 1.03 . . . . 74.42 108.894 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -136.14 147.83 47.92 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.462 0.705 . . . . 74.3 110.208 -179.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.5 tpp180 -76.57 117.58 18.36 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.785 0.834 . . . . 73.35 110.171 177.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -119.0 126.56 52.02 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 107.592 -1.262 . . . . 71.41 107.592 168.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 65.54 -104.5 1.0 Allowed Glycine 0 C--N 1.346 1.118 0 N-CA-C 111.122 -0.791 . . . . 72.12 111.122 -172.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -127.16 -5.06 6.14 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.89 0.876 . . . . 73.43 110.075 174.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 77.6 p -102.38 174.7 5.79 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.503 0.721 . . . . 73.31 111.171 -176.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -112.39 133.75 54.3 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.557 1.143 . . . . 74.3 110.637 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.1 t -128.23 151.99 48.62 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.26 1.024 . . . . 74.42 108.932 177.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.661 HG22 HG22 ' A' ' 59' ' ' VAL . 77.9 t -92.52 119.25 39.78 Favored 'Isoleucine or valine' 0 C--O 1.241 0.61 0 N-CA-C 109.941 -0.392 . . . . 74.23 109.941 175.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -70.07 -56.79 6.0 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 114.813 -1.085 . . . . 73.3 110.607 173.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -160.62 139.23 10.16 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 123.625 0.578 . . . . 64.4 110.02 178.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.452 HG23 HG22 ' A' ' 57' ' ' VAL . 59.3 mt -89.9 105.43 16.13 Favored 'Isoleucine or valine' 0 C--O 1.239 0.517 0 N-CA-C 107.975 -1.12 . . . . 73.44 107.975 168.292 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 96.1 m -97.14 105.85 18.08 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.485 0.714 . . . . 53.13 109.762 175.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 12.8 ttp180 -71.22 149.28 46.43 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 109.192 -0.67 . . . . 75.3 109.192 172.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 12.0 t . . . . . 0 CA--C 1.543 0.696 0 N-CA-C 109.423 -0.584 . . . . 74.52 109.423 175.028 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 . . . . . 0 N--CA 1.481 1.087 0 CA-C-O 121.281 0.562 . . . . 65.23 110.626 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.543 ' O ' HG23 ' A' ' 11' ' ' VAL . 20.2 mm-40 -64.36 -39.73 94.45 Favored 'General case' 0 C--O 1.207 -1.162 0 CA-C-O 118.008 -0.996 . . . . 75.03 111.06 178.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.3 mptt -59.55 -36.4 76.11 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-N 119.319 0.963 . . . . 75.04 110.956 176.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -59.51 -31.33 69.27 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.281 0.632 . . . . 62.31 110.694 176.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.44 ' O ' HG23 ' A' ' 14' ' ' VAL . 38.3 mt-30 -82.45 -47.61 12.04 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 115.444 -0.798 . . . . 64.44 111.887 174.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.579 HG21 HD12 ' A' ' 40' ' ' ILE . 73.1 t -73.1 -45.5 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.186 0 C-N-CA 123.783 0.833 . . . . 54.24 112.08 -165.312 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.637 ' HD2' HG11 ' A' ' 30' ' ' VAL . 25.8 mtmm -69.43 -26.16 64.47 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 109.565 -0.532 . . . . 62.13 109.565 179.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.426 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 23.0 tt0 -71.34 -44.84 64.31 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.2 1.0 . . . . 63.41 110.318 176.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.465 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 82.6 t -61.51 -48.14 90.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 N-CA-C 108.85 -0.796 . . . . 63.01 108.85 174.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.9 -39.84 93.36 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.49 1.116 . . . . 75.24 112.228 -174.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -69.94 -38.05 76.07 Favored 'General case' 0 C--N 1.355 0.826 0 O-C-N 123.263 0.352 . . . . 74.24 110.278 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 28.2 mm-40 -68.23 -34.8 76.89 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 122.743 0.417 . . . . 74.5 110.618 177.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.638 ' HB3' HD11 ' A' ' 71' ' ' ILE . 31.7 mmmt -63.84 -33.0 74.71 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 122.952 0.501 . . . . 70.33 110.813 176.139 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.782 ' HB3' HD12 ' A' ' 46' ' ' LEU . 32.6 mt -76.15 -36.97 58.53 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.733 -0.667 . . . . 73.31 111.532 174.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.0 mt -73.58 -16.38 61.25 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.251 0.62 . . . . 64.13 111.614 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -61.77 -39.5 91.86 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.433 0.635 . . . . 55.3 110.508 167.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.541 HE22 HG21 ' A' ' 71' ' ' ILE . 42.9 mt-30 -84.8 -34.25 22.79 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 114.445 -1.252 . . . . 64.14 110.976 -175.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.425 ' HB3' HD11 ' A' ' 46' ' ' LEU . 15.2 t -153.03 88.81 3.77 Favored Pre-proline 0 CA--C 1.555 1.159 0 N-CA-C 109.169 -0.678 . . . . 71.31 109.169 -177.411 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -62.54 -44.57 17.33 Favored 'Trans proline' 0 C--N 1.384 2.418 0 C-N-CA 123.425 2.75 . . . . 72.3 114.36 -176.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -83.15 -2.99 56.88 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.359 0.663 . . . . 74.23 112.006 -171.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.6 t -83.74 158.39 21.79 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 122.922 0.489 . . . . 71.31 111.218 177.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.34 134.13 35.2 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 123.481 0.712 . . . . 70.12 109.86 177.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.432 ' HA ' ' O ' ' A' ' 45' ' ' GLU . 80.9 t -117.21 113.98 44.35 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 C-N-CA 123.522 0.729 . . . . 65.23 109.912 177.215 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -109.48 122.12 46.7 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.459 1.104 . . . . 60.42 109.062 172.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.637 HG11 ' HD2' ' A' ' 12' ' ' LYS . 57.5 t -65.79 116.33 4.92 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 N-CA-C 109.238 -0.653 . . . . 75.32 109.238 176.042 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.0 tpt180 -83.14 -51.89 7.11 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.389 0.676 . . . . 60.3 110.267 -174.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.401 ' HB2' ' HB2' ' A' ' 43' ' ' GLU . 37.1 mtp85 -146.0 156.4 43.47 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.6 1.16 . . . . 72.24 109.67 -177.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 75.1 t -132.64 117.62 31.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 C-N-CA 123.891 0.876 . . . . 65.3 108.839 175.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -112.91 128.44 56.47 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.21 0.604 . . . . 74.31 110.033 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.5 tptp -108.66 109.76 21.03 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.296 1.039 . . . . 73.2 108.792 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.0 mm-40 -132.1 103.17 6.12 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.426 0.69 . . . . 70.34 109.953 -178.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.34 -101.99 0.89 Allowed Glycine 0 C--N 1.356 1.676 0 CA-C-N 115.92 -0.582 . . . . 74.12 112.519 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -113.22 -23.22 10.07 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.524 0.73 . . . . 75.12 109.715 173.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 16.6 m -85.14 105.71 16.06 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.491 0.716 . . . . 65.21 110.437 -176.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.579 HD12 HG21 ' A' ' 11' ' ' VAL . 31.2 mt -85.46 108.1 16.86 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 N-CA-C 109.29 -0.633 . . . . 73.15 109.29 168.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 -87.71 95.93 10.25 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 108.458 -0.942 . . . . 64.42 108.458 175.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.5 t -88.15 118.38 33.66 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 N-CA-C 108.824 -0.806 . . . . 61.04 108.824 179.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.401 ' HB2' ' HB2' ' A' ' 32' ' ' ARG . 46.3 mt-10 -90.3 120.85 31.79 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 108.605 -0.887 . . . . 73.21 108.605 173.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.5 mp -122.44 170.05 10.36 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 109.728 -0.471 . . . . 65.43 109.728 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.586 ' HG3' ' HG3' ' A' ' 52' ' ' LYS . 29.4 tt0 -120.7 105.16 10.51 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.48 1.112 . . . . 64.34 108.695 -176.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.782 HD12 ' HB3' ' A' ' 19' ' ' LEU . 6.9 tt -107.27 133.83 51.25 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 106.402 -1.703 . . . . 73.53 106.402 172.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 87.1 mtt180 . . . . . 0 CA--C 1.539 0.534 0 CA-C-O 121.834 0.826 . . . . 74.51 109.66 -174.096 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.608 ' HE2' HD21 ' A' ' 54' ' ' ASN . 84.4 tttt . . . . . 0 CA--C 1.541 0.623 0 N-CA-C 109.766 -0.457 . . . . 73.43 109.766 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -111.89 118.87 36.71 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 107.851 -1.166 . . . . 71.4 107.851 172.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.608 HD21 ' HE2' ' A' ' 52' ' ' LYS . 43.6 m-80 -88.06 132.9 34.11 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 109.878 -0.415 . . . . 44.2 109.878 177.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.439 ' CE2' ' HB3' ' A' ' 46' ' ' LEU . 66.6 m-85 -124.07 119.8 30.55 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 109.167 -0.679 . . . . 62.2 109.167 178.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 26.7 m -87.11 101.9 13.93 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 108.507 -0.923 . . . . 50.32 108.507 173.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.498 HG22 HG23 ' A' ' 71' ' ' ILE . 46.3 t -92.04 104.6 15.75 Favored 'Isoleucine or valine' 0 C--O 1.24 0.595 0 N-CA-C 108.007 -1.109 . . . . 55.4 108.007 177.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -80.93 105.24 12.01 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 114.511 -1.222 . . . . 75.55 109.344 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 20.8 t -112.91 134.57 55.11 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 108.806 -0.812 . . . . 73.43 108.806 178.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -121.95 142.71 50.02 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.302 0.641 . . . . 63.05 111.183 -174.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.85 114.92 19.14 Favored 'General case' 0 C--N 1.35 0.596 0 C-N-CA 123.787 0.835 . . . . 72.25 109.53 174.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -120.84 102.92 8.69 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 107.647 -1.242 . . . . 65.41 107.647 172.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 72.66 -99.53 0.92 Allowed Glycine 0 C--N 1.347 1.177 0 N-CA-C 110.211 -1.156 . . . . 74.43 110.211 -172.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -122.48 -19.19 6.45 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.303 1.041 . . . . 72.02 110.261 169.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 68.1 p -76.79 136.97 38.99 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 122.911 0.485 . . . . 75.22 111.364 -175.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -96.23 111.81 23.75 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.07 0.948 . . . . 75.23 109.891 177.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.2 t -105.01 139.73 39.25 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.734 0.814 . . . . 75.14 109.844 -177.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.488 HG21 ' HG3' ' A' ' 18' ' ' LYS . 59.0 t -91.14 116.65 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 O-C-N 121.709 -0.619 . . . . 71.43 110.379 177.198 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -71.37 -57.38 4.51 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.532 1.133 . . . . 54.13 111.091 175.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -162.09 133.53 5.29 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.584 -0.734 . . . . 50.5 109.844 -173.031 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.638 HD11 ' HB3' ' A' ' 18' ' ' LYS . 56.5 mt -91.48 105.21 16.3 Favored 'Isoleucine or valine' 0 C--O 1.241 0.614 0 N-CA-C 106.636 -1.616 . . . . 73.33 106.636 163.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 27.2 m -101.25 108.46 20.12 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.108 -0.701 . . . . 61.23 109.108 -176.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -67.54 138.67 56.68 Favored 'General case' 0 C--O 1.241 0.625 0 N-CA-C 108.81 -0.811 . . . . 74.02 108.81 171.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.1 t . . . . . 0 C--O 1.247 0.934 0 C-N-CA 123.58 0.752 . . . . 73.25 110.605 175.285 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.424 ' HA ' ' HD2' ' A' ' 9' ' ' ARG . 11.7 tp10 . . . . . 0 C--O 1.245 0.816 0 N-CA-C 111.312 0.116 . . . . 74.23 111.312 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.546 ' O ' HG23 ' A' ' 11' ' ' VAL . 72.9 mt-10 -50.5 -66.74 0.34 Allowed 'General case' 0 C--N 1.364 1.205 0 O-C-N 124.022 0.826 . . . . 70.35 109.981 173.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.478 ' HD2' ' HB2' ' A' ' 7' ' ' GLU . 10.6 mptt -66.0 -27.82 68.42 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 123.908 0.755 . . . . 70.22 111.295 -169.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.424 ' HD2' ' HA ' ' A' ' 6' ' ' GLU . 90.5 mtt180 -59.71 -40.14 86.94 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.091 0.556 . . . . 72.52 110.398 176.295 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -77.91 -51.38 10.51 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 115.107 -0.951 . . . . 64.43 110.751 173.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.546 HG23 ' O ' ' A' ' 7' ' ' GLU . 52.0 t -66.04 -44.77 91.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 123.653 0.781 . . . . 64.43 112.486 -164.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.403 ' HD2' HG11 ' A' ' 30' ' ' VAL . 29.1 mtmm -66.05 -31.97 73.16 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 123.165 0.29 . . . . 71.42 110.394 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.412 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 8.4 tt0 -70.76 -43.82 68.01 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 124.107 0.879 . . . . 74.3 110.185 178.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.479 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 87.8 t -65.08 -39.83 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 N-CA-C 109.557 -0.534 . . . . 64.14 109.557 176.023 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.91 -44.2 81.37 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.198 0.999 . . . . 71.51 111.598 -175.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -67.85 -34.82 77.45 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 123.793 0.683 . . . . 75.44 110.164 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.484 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 22.4 mm-40 -61.01 -46.02 92.46 Favored 'General case' 0 C--N 1.356 0.848 0 O-C-N 123.633 0.583 . . . . 65.54 111.077 177.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.607 ' HB3' HD11 ' A' ' 71' ' ' ILE . 71.5 mmtt -67.22 -30.66 70.65 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.669 0.606 . . . . 75.45 111.09 -178.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.565 ' HB3' HD12 ' A' ' 46' ' ' LEU . 41.7 mt -70.15 -36.26 74.62 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.396 0.678 . . . . 64.24 111.442 174.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.3 mt -76.06 -22.89 55.15 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 123.764 0.826 . . . . 55.21 110.57 176.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 7.4 mm-40 -69.15 -36.94 77.97 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.261 0.624 . . . . 75.14 110.147 171.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -76.16 -42.06 47.86 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.21 0.604 . . . . 73.12 110.944 176.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.4 t -148.85 96.71 3.75 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 123.062 0.545 . . . . 73.12 110.368 -174.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -82.55 -1.98 10.83 Favored 'Trans proline' 0 C--N 1.372 1.805 0 C-N-CA 123.228 2.619 . . . . 71.4 112.434 172.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -83.41 -3.88 57.97 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.671 1.188 . . . . 61.11 111.676 178.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 34.4 p -127.09 142.56 51.49 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.382 0.673 . . . . 74.42 111.979 -168.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -77.85 136.43 38.07 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 123.818 0.699 . . . . 73.25 109.587 169.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 60.3 t -112.61 134.99 53.43 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 C-N-CA 123.973 0.909 . . . . 74.03 108.938 177.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -128.95 149.6 50.73 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.826 0.851 . . . . 70.11 109.396 176.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.403 HG11 ' HD2' ' A' ' 12' ' ' LYS . 73.8 t -77.05 110.35 12.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 N-CA-C 109.96 -0.385 . . . . 73.54 109.96 176.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -81.44 -59.57 2.58 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.656 0.782 . . . . 63.12 110.09 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.424 ' HB2' ' HB2' ' A' ' 43' ' ' GLU . 17.6 mmm180 -148.82 167.26 26.12 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.885 1.274 . . . . 70.2 108.981 -176.276 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.403 HG22 HG13 ' A' ' 42' ' ' VAL . 59.2 t -135.45 139.76 46.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 N-CA-C 108.704 -0.85 . . . . 62.13 108.704 171.179 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -125.6 108.25 11.39 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 109.112 -0.699 . . . . 75.04 109.112 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -96.43 113.51 25.1 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 107.972 -1.122 . . . . 74.04 107.972 176.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 92.4 mm-40 -131.96 99.05 4.61 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.879 -0.786 . . . . 74.51 108.879 176.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 63.06 -102.53 0.53 Allowed Glycine 0 C--N 1.348 1.238 0 O-C-N 124.386 1.054 . . . . 72.3 112.908 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.493 HD22 ' HB3' ' A' ' 61' ' ' ARG . 18.1 m120 -97.15 -39.76 9.13 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.571 0.748 . . . . 63.22 109.838 174.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.438 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 11.5 m -80.69 96.42 6.9 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 123.296 0.638 . . . . 60.31 110.803 -172.061 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 28.8 mt -87.54 107.32 17.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 115.779 -0.646 . . . . 64.02 109.357 168.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 31.6 mtm180 -87.82 96.07 10.33 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 108.01 -1.107 . . . . 72.22 108.01 174.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.403 HG13 HG22 ' A' ' 33' ' ' VAL . 48.6 t -82.59 121.17 35.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 N-CA-C 109.034 -0.728 . . . . 74.41 109.034 177.073 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.424 ' HB2' ' HB2' ' A' ' 32' ' ' ARG . 37.6 mt-10 -89.45 118.11 28.86 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.416 -0.811 . . . . 74.15 109.095 176.116 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.8 mp -122.99 164.04 19.29 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 108.823 -0.806 . . . . 74.12 108.823 176.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -125.56 111.82 15.48 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.633 0.773 . . . . 70.52 108.916 -169.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.565 HD12 ' HB3' ' A' ' 19' ' ' LEU . 8.5 tt -120.41 137.68 54.18 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.173 1.389 . . . . 62.14 108.361 -171.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 14.5 mtm180 . . . . . 0 N--CA 1.48 1.07 0 N-CA-C 109.476 -0.565 . . . . 74.22 109.476 -178.507 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt . . . . . 0 C--O 1.241 0.629 0 N-CA-C 108.983 -0.747 . . . . 71.21 108.983 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -108.59 134.61 51.11 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.907 0.883 . . . . 72.13 110.399 -175.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -88.43 120.87 30.21 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.633 -0.712 . . . . 74.54 110.525 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.517 ' CE2' ' HB3' ' A' ' 46' ' ' LEU . 19.1 m-85 -104.71 157.8 16.94 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.02 0.928 . . . . 65.31 109.801 177.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 85.3 m -134.23 103.04 5.59 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 107.984 -1.117 . . . . 70.33 107.984 173.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.43 HG22 HG23 ' A' ' 71' ' ' ILE . 52.0 t -90.1 105.25 16.01 Favored 'Isoleucine or valine' 0 C--O 1.241 0.647 0 N-CA-C 107.56 -1.274 . . . . 74.32 107.56 -179.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -77.12 111.27 12.54 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 114.891 -1.049 . . . . 62.31 109.129 -179.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 24.7 t -122.81 122.59 66.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 123.635 0.774 . . . . 51.01 109.39 -178.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.438 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 29.8 tt0 -105.85 145.57 31.05 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.114 0.965 . . . . 72.3 110.859 -176.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.493 ' HB3' HD22 ' A' ' 38' ' ' ASN . 14.5 tpp180 -75.42 121.25 22.02 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 109.782 -0.451 . . . . 75.1 109.782 171.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -117.39 101.8 8.7 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.503 -0.925 . . . . 72.14 108.503 167.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.75 -106.24 1.76 Allowed Glycine 0 C--N 1.348 1.239 0 CA-C-N 115.96 -0.564 . . . . 64.32 111.98 -178.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -108.98 -19.71 13.3 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.342 0.657 . . . . 64.32 110.296 177.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.2 p -93.76 173.88 7.46 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.465 0.65 . . . . 70.24 111.442 -178.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -116.08 150.55 37.15 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.479 1.111 . . . . 73.15 109.442 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.3 t -134.77 123.15 23.14 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 109.457 -0.571 . . . . 72.34 109.457 -179.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.557 HG21 ' HG3' ' A' ' 18' ' ' LYS . 95.5 t -74.93 103.67 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 N-CA-C 108.812 -0.81 . . . . 72.24 108.812 175.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.5 mmmp? -64.4 -52.77 56.54 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 123.934 0.894 . . . . 74.03 110.196 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -163.62 152.61 14.17 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.464 -0.789 . . . . 64.3 109.895 178.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.607 HD11 ' HB3' ' A' ' 18' ' ' LYS . 70.5 mt -101.95 110.14 27.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 N-CA-C 108.029 -1.1 . . . . 72.04 108.029 170.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 17.4 m -91.65 142.8 27.23 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 108.542 -0.91 . . . . 54.01 108.542 178.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 27.9 ttp180 -118.31 144.33 45.93 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 107.536 -1.283 . . . . 63.21 107.536 168.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.4 t . . . . . 0 C--O 1.248 0.996 0 C-N-CA 122.943 0.497 . . . . 75.53 109.994 176.294 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.412 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 45.2 mt-10 . . . . . 0 N--CA 1.481 1.085 0 N-CA-C 110.348 -0.241 . . . . 74.35 110.348 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.509 ' O ' HG23 ' A' ' 11' ' ' VAL . 51.1 mm-40 -63.47 -40.93 98.42 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 123.899 0.749 . . . . 75.13 111.35 178.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.19 -41.65 98.55 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.247 0.619 . . . . 61.55 110.32 179.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -58.83 -44.79 90.97 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 124.026 0.93 . . . . 72.12 110.822 175.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.452 ' O ' HG23 ' A' ' 14' ' ' VAL . 68.5 mt-30 -62.96 -45.11 93.97 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 114.904 -1.044 . . . . 74.44 111.089 179.249 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.52 HG21 HD12 ' A' ' 40' ' ' ILE . 87.6 t -66.71 -43.51 90.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 123.621 0.769 . . . . 73.34 111.423 -176.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -61.45 -37.69 84.49 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 123.486 0.491 . . . . 75.54 110.442 176.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.512 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.5 tt0 -65.79 -49.14 69.38 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 124.119 0.887 . . . . 74.43 110.323 179.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 10' ' ' GLN . 89.0 t -58.12 -45.69 88.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 C-N-CA 123.068 0.547 . . . . 62.34 109.784 176.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.84 -42.29 97.63 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.175 0.99 . . . . 51.41 112.179 -175.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -73.72 -35.44 65.09 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 116.317 -0.401 . . . . 72.34 110.667 -176.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 25.3 mm-40 -65.87 -37.13 85.33 Favored 'General case' 0 C--N 1.353 0.732 0 O-C-N 123.422 0.451 . . . . 75.33 110.369 176.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.634 ' HB3' HD11 ' A' ' 71' ' ' ILE . 65.9 mmtt -63.26 -37.1 85.94 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.347 0.659 . . . . 74.53 110.897 176.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 23.8 mt -72.49 -30.65 64.71 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 115.85 -0.614 . . . . 64.42 111.414 176.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 75.5 mt -76.19 -19.68 58.2 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.333 0.653 . . . . 64.31 111.045 177.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -77.0 -21.12 55.17 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.018 0.527 . . . . 71.22 110.714 170.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 -88.64 -38.12 15.06 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.165 0.586 . . . . 73.25 110.226 175.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.8 t -157.31 102.51 1.87 Allowed Pre-proline 0 CA--C 1.552 1.048 0 C-N-CA 124.208 1.003 . . . . 42.32 109.215 -176.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -77.04 -27.61 6.69 Favored 'Trans proline' 0 C--N 1.373 1.824 0 C-N-CA 122.796 2.331 . . . . 74.24 112.851 -176.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -74.46 -27.93 60.8 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.766 0.826 . . . . 62.54 111.18 -173.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 54.5 m -80.47 130.04 34.9 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 123.299 0.64 . . . . 74.13 111.373 -174.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -73.67 123.49 24.15 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 123.509 0.724 . . . . 75.14 109.697 175.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.54 HG22 HD12 ' A' ' 46' ' ' LEU . 40.8 t -99.68 113.29 34.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 123.315 0.646 . . . . 74.34 109.617 -177.074 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -94.61 151.72 19.09 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.945 -0.761 . . . . 52.11 108.945 174.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 p -87.09 105.75 15.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 N-CA-C 108.936 -0.765 . . . . 62.44 108.936 171.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -77.21 -42.7 36.41 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.249 0.62 . . . . 72.41 110.435 -177.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 17.5 tpp85 -170.01 155.55 5.63 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.976 0.91 . . . . 61.31 109.452 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 25.2 t -117.21 117.19 54.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.354 -0.98 . . . . 70.15 108.354 171.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -104.55 145.59 30.09 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 109.423 -0.584 . . . . 61.22 109.423 174.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.565 ' HG2' HG12 ' A' ' 40' ' ' ILE . 13.2 tmtt? -136.53 117.25 13.99 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 107.166 -1.42 . . . . 74.13 107.166 -177.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -133.25 96.3 3.71 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.082 0.953 . . . . 63.51 108.733 -175.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.47 -92.76 0.28 Allowed Glycine 0 C--N 1.348 1.248 0 O-C-N 123.555 0.535 . . . . 72.53 112.215 -177.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.435 HD22 ' HB3' ' A' ' 61' ' ' ARG . 19.3 m120 -114.18 -25.23 8.57 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.971 0.909 . . . . 75.23 110.741 175.079 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.567 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 19.9 m -81.79 103.8 11.73 Favored 'General case' 0 C--O 1.24 0.587 0 C-N-CA 123.158 0.583 . . . . 75.11 111.252 -176.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.565 HG12 ' HG2' ' A' ' 35' ' ' LYS . 39.6 mt -86.76 107.12 16.54 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 N-CA-C 109.063 -0.717 . . . . 63.31 109.063 168.4 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.425 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 95.0 mtt180 -92.29 96.72 10.45 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 108.406 -0.961 . . . . 73.34 108.406 176.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.412 HG12 ' HG ' ' A' ' 44' ' ' LEU . 39.2 t -80.25 120.7 32.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 N-CA-C 108.421 -0.955 . . . . 54.34 108.421 176.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -84.89 115.49 22.8 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 107.482 -1.303 . . . . 74.53 107.482 170.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.412 ' HG ' HG12 ' A' ' 42' ' ' VAL . 1.9 mp -117.82 142.87 46.82 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 109.594 -0.521 . . . . 73.5 109.594 178.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -107.2 104.82 14.55 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.916 0.886 . . . . 72.02 108.787 -175.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.54 HD12 HG22 ' A' ' 28' ' ' VAL . 8.3 tt -117.2 135.46 53.77 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.323 1.049 . . . . 60.3 108.747 -175.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 64.6 mtm180 . . . . . 0 CA--C 1.542 0.671 0 N-CA-C 109.306 -0.627 . . . . 73.33 109.306 -178.395 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.9 tttt . . . . . 0 N--CA 1.472 0.646 0 CA-C-O 120.86 0.362 . . . . 73.21 110.208 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -127.64 118.78 24.51 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.775 0.83 . . . . 72.2 109.815 -177.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -80.32 147.07 31.27 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.812 -0.81 . . . . 62.1 108.812 171.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 -129.88 120.57 25.13 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.762 0.825 . . . . 55.24 108.829 179.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 90.8 m -85.44 100.64 12.01 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 108.404 -0.962 . . . . 71.21 108.404 170.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.483 HG22 HG23 ' A' ' 71' ' ' ILE . 43.4 t -97.52 102.87 13.99 Favored 'Isoleucine or valine' 0 C--O 1.243 0.728 0 N-CA-C 107.591 -1.263 . . . . 72.25 107.591 175.075 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.425 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 31.7 mt-10 -80.57 101.52 9.21 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 114.319 -1.31 . . . . 73.24 108.483 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.502 ' HB ' HG13 ' A' ' 11' ' ' VAL . 21.2 t -109.39 109.45 28.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 N-CA-C 107.84 -1.17 . . . . 71.01 107.84 177.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.567 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 45.8 tt0 -101.9 146.34 27.97 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.729 0.811 . . . . 75.41 109.767 -175.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.435 ' HB3' HD22 ' A' ' 38' ' ' ASN . 8.6 tpt180 -80.49 111.24 16.72 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.659 0.784 . . . . 73.11 110.595 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 -106.11 93.5 4.65 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 108.398 -0.964 . . . . 55.23 108.398 174.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.08 -100.69 0.73 Allowed Glycine 0 C--N 1.344 1.011 0 CA-C-N 115.549 -0.75 . . . . 44.45 112.045 -177.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -105.65 -26.08 11.99 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.23 1.012 . . . . 73.41 110.831 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.2 p -93.61 160.65 14.68 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.579 0.752 . . . . 73.13 111.686 -174.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -108.16 109.81 21.3 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.625 1.17 . . . . 74.41 109.821 176.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 9.8 t -103.83 127.67 51.31 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.67 0.788 . . . . 71.14 110.712 -178.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.467 HG22 HG22 ' A' ' 59' ' ' VAL . 63.6 t -77.51 110.14 12.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 N-CA-C 109.617 -0.512 . . . . 64.01 109.617 176.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -69.05 -49.52 56.81 Favored 'General case' 0 C--O 1.24 0.58 0 C-N-CA 123.363 0.665 . . . . 74.11 110.534 178.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -166.69 143.1 4.66 Favored 'General case' 0 C--N 1.348 0.501 0 CA-C-N 116.291 -0.413 . . . . 73.2 111.49 177.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.634 HD11 ' HB3' ' A' ' 18' ' ' LYS . 56.8 mt -97.84 106.95 19.37 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 N-CA-C 107.739 -1.208 . . . . 73.13 107.739 166.442 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 37.4 m -102.51 119.73 39.31 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.307 0.643 . . . . 75.41 109.48 178.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 28.4 ttp180 -75.93 148.08 38.47 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 109.331 -0.618 . . . . 74.43 109.331 176.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.4 t . . . . . 0 N--CA 1.478 0.925 0 C-N-CA 124.394 1.078 . . . . 71.14 112.616 -173.106 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 . . . . . 0 N--CA 1.472 0.647 0 N-CA-C 111.769 0.285 . . . . 65.14 111.769 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.506 ' O ' HG23 ' A' ' 11' ' ' VAL . 9.8 mm-40 -57.42 -43.32 83.7 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.987 0.915 . . . . 72.43 111.914 -175.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.454 ' HD2' ' N ' ' A' ' 8' ' ' LYS . 10.5 mptt -68.76 -48.21 64.3 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 108.872 -0.788 . . . . 74.12 108.872 -179.276 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -59.13 -34.53 72.16 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.697 1.199 . . . . 61.25 112.117 -177.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -70.89 -53.62 14.45 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.633 0.773 . . . . 72.22 110.817 178.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.64 HG13 ' HB ' ' A' ' 59' ' ' VAL . 59.8 t -63.36 -44.59 99.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 123.27 0.628 . . . . 75.31 111.639 -172.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.607 ' HD2' HG11 ' A' ' 30' ' ' VAL . 48.2 mtmt -66.02 -33.8 76.63 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.396 0.679 . . . . 74.31 110.592 -179.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.509 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.4 tt0 -66.45 -59.11 3.97 Favored 'General case' 0 C--N 1.355 0.811 0 O-C-N 123.96 0.788 . . . . 63.34 109.699 176.215 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.4 t -52.49 -44.77 45.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 C-N-CA 124.435 1.094 . . . . 70.4 111.129 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.431 ' HB1' HD11 ' A' ' 44' ' ' LEU . . . -61.69 -42.05 98.41 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.282 1.033 . . . . 62.22 111.646 -179.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.407 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 32.3 tttm -65.54 -43.72 89.09 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.441 1.096 . . . . 61.3 110.719 175.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 15.7 mm-40 -61.24 -41.91 97.71 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 123.843 0.715 . . . . 74.15 110.573 -177.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.433 ' HB3' HD11 ' A' ' 71' ' ' ILE . 69.6 mmtt -64.56 -41.52 96.26 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 124.196 0.935 . . . . 75.11 110.966 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.451 HD23 ' NE2' ' A' ' 22' ' ' GLN . 77.3 mt -70.17 -27.61 64.66 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.0 0.52 . . . . 75.01 111.733 177.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 90.6 mt -73.63 -33.89 64.75 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.436 0.694 . . . . 40.12 110.36 174.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -71.1 -36.68 72.26 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.475 0.71 . . . . 74.13 110.783 177.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.451 ' NE2' HD23 ' A' ' 19' ' ' LEU . 24.2 mt-30 -76.43 -35.55 58.45 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.558 0.743 . . . . 74.42 111.457 178.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 29.8 t -148.24 93.74 4.35 Favored Pre-proline 0 CA--C 1.55 0.971 0 N-CA-C 109.433 -0.58 . . . . 70.23 109.433 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -76.0 -4.07 14.67 Favored 'Trans proline' 0 C--N 1.378 2.119 0 C-N-CA 122.792 2.328 . . . . 71.42 112.867 173.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.455 HD22 ' N ' ' A' ' 25' ' ' ASN . 0.7 OUTLIER -83.07 -19.46 36.8 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.055 0.942 . . . . 73.54 110.059 173.627 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.4 ' OG ' ' HG ' ' A' ' 46' ' ' LEU . 39.4 t -86.45 141.02 29.43 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 123.386 0.675 . . . . 75.52 112.325 -173.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -89.87 108.93 20.0 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 107.3 -1.37 . . . . 74.13 107.3 164.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 88.6 t -98.48 113.37 32.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 C-N-CA 123.82 0.848 . . . . 74.34 109.206 -176.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 61.3 tp60 -117.87 124.21 47.75 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.578 0.751 . . . . 75.43 109.811 -178.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.607 HG11 ' HD2' ' A' ' 12' ' ' LYS . 55.8 t -62.8 108.1 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 N-CA-C 109.309 -0.626 . . . . 75.43 109.309 174.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 24.1 tpt85 -88.43 -36.27 16.6 Favored 'General case' 0 CA--C 1.549 0.915 0 CA-C-N 115.28 -0.873 . . . . 72.24 111.607 -175.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -170.0 165.49 9.44 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.328 0.651 . . . . 71.11 109.336 -177.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.499 HG21 ' HD3' ' A' ' 12' ' ' LYS . 97.5 t -141.69 123.44 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 124.012 0.925 . . . . 72.51 109.594 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -101.31 109.99 21.92 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.209 0.604 . . . . 72.41 109.537 170.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.512 ' HG2' HG12 ' A' ' 40' ' ' ILE . 6.2 tmtm? -99.09 108.53 21.19 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 108.303 -0.999 . . . . 64.35 108.303 179.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -126.99 99.4 5.7 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.804 0.842 . . . . 73.41 110.413 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.04 -120.78 17.06 Favored Glycine 0 C--N 1.356 1.654 0 CA-C-N 115.322 -0.854 . . . . 73.23 112.641 176.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -77.05 -35.03 57.11 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.521 0.728 . . . . 74.11 110.654 178.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.458 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 89.5 m -87.95 126.39 35.03 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-O 121.319 0.58 . . . . 65.42 110.216 -175.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.512 HG12 ' HG2' ' A' ' 35' ' ' LYS . 33.3 mt -115.27 107.94 24.07 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 N-CA-C 107.836 -1.172 . . . . 54.3 107.836 173.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.582 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 94.4 mtt180 -83.31 131.62 35.07 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 123.905 0.882 . . . . 75.14 108.674 173.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.483 HG13 HG22 ' A' ' 33' ' ' VAL . 35.5 t -118.81 116.83 52.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 108.634 -0.876 . . . . 74.11 108.634 175.247 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -83.68 103.68 13.19 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 107.869 -1.159 . . . . 75.21 107.869 172.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.434 ' HG ' HG12 ' A' ' 42' ' ' VAL . 0.6 OUTLIER -109.6 166.85 10.58 Favored 'General case' 0 N--CA 1.484 1.235 0 N-CA-C 107.963 -1.125 . . . . 71.13 107.963 173.458 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -122.12 125.83 47.03 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.816 0.341 . . . . 72.35 110.255 -173.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.4 ' HG ' ' OG ' ' A' ' 26' ' ' SER . 10.0 tt -96.85 115.57 27.66 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.911 1.284 . . . . 70.51 107.692 -177.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 . . . . . 0 N--CA 1.482 1.173 0 C-N-CA 123.962 0.905 . . . . 74.02 110.222 -177.739 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 83.8 tttt . . . . . 0 N--CA 1.467 0.41 0 N-CA-C 107.579 -1.267 . . . . 74.44 107.579 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -138.32 130.97 29.32 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.862 0.865 . . . . 63.13 109.78 -178.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 35.6 m-80 -83.4 127.23 33.51 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.352 0.661 . . . . 53.31 110.61 178.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -106.5 119.98 40.72 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.985 0.914 . . . . 72.44 109.351 176.239 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 80.5 m -86.7 101.7 13.53 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 124.762 1.225 . . . . 62.32 108.817 172.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.546 HG22 HG23 ' A' ' 71' ' ' ILE . 45.5 t -93.31 105.45 16.84 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 N-CA-C 108.437 -0.949 . . . . 63.24 108.437 179.124 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.582 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 33.6 mt-10 -77.94 112.15 14.54 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.796 0.839 . . . . 61.25 108.774 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.64 ' HB ' HG13 ' A' ' 11' ' ' VAL . 17.6 t -124.66 115.31 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 N-CA-C 108.573 -0.899 . . . . 33.34 108.573 177.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.459 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 29.4 tt0 -100.7 148.3 25.03 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.069 0.948 . . . . 74.34 110.233 -176.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.12 114.13 19.76 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 109.262 -0.644 . . . . 73.12 109.262 176.161 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 -119.81 86.61 2.59 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 124.275 1.03 . . . . 65.15 108.276 177.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 68.55 -132.37 27.17 Favored Glycine 0 C--N 1.346 1.101 0 CA-C-N 115.692 -0.685 . . . . 61.14 111.631 -175.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -80.59 -2.17 45.25 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.714 0.806 . . . . 55.13 111.721 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 73.8 p -114.56 150.96 34.16 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.084 0.554 . . . . 74.45 110.563 -176.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 96.3 m95 -98.32 119.18 36.55 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.056 0.942 . . . . 75.42 108.827 168.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 10.0 t -103.13 121.29 42.32 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.442 0.697 . . . . 72.0 109.875 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 51.2 t -76.29 106.97 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 108.494 -0.928 . . . . 75.22 108.494 176.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.459 ' HD3' ' HB3' ' A' ' 60' ' ' GLU . 1.5 mmmp? -65.02 -57.13 9.49 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 115.589 -0.732 . . . . 61.35 110.128 -179.352 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 63.1 ttt180 -167.26 136.25 2.71 Favored 'General case' 0 C--N 1.352 0.676 0 CA-C-N 116.008 -0.542 . . . . 75.24 110.597 178.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.546 HG23 HG22 ' A' ' 57' ' ' VAL . 71.9 mt -87.35 105.91 15.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 107.653 -1.24 . . . . 73.41 107.653 171.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 19.6 m -107.07 115.5 30.29 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.341 0.656 . . . . 75.54 109.506 -174.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -68.84 149.9 48.42 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.015 0.526 . . . . 71.52 109.753 172.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.8 t . . . . . 0 N--CA 1.475 0.798 0 C-N-CA 123.791 0.837 . . . . 73.51 110.202 167.431 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 . . . . . 0 CA--C 1.546 0.792 0 CA-C-O 120.571 0.224 . . . . 54.24 110.802 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -64.22 -40.96 97.14 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 116.196 -0.456 . . . . 73.33 111.097 177.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.554 ' HG3' HG11 ' A' ' 33' ' ' VAL . 1.0 OUTLIER -62.49 -42.41 99.48 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 123.713 0.633 . . . . 63.3 110.016 177.755 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 41.8 ttt180 -56.77 -44.31 81.7 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.776 0.831 . . . . 74.33 111.131 177.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.524 ' O ' HG23 ' A' ' 14' ' ' VAL . 46.4 mt-30 -68.92 -45.97 69.49 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 114.929 -1.032 . . . . 72.12 110.945 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.61 HG21 HD12 ' A' ' 40' ' ' ILE . 55.1 t -70.84 -43.47 76.96 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 124.065 0.946 . . . . 74.34 112.243 -173.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -61.66 -36.05 79.72 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.171 0.588 . . . . 71.34 110.168 176.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.508 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 8.8 tt0 -64.22 -52.51 58.47 Favored 'General case' 0 C--N 1.354 0.764 0 O-C-N 124.088 0.867 . . . . 74.41 110.21 176.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.525 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 84.9 t -55.25 -44.43 75.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 123.137 0.575 . . . . 63.54 110.22 178.057 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.01 -47.91 75.79 Favored 'General case' 0 C--O 1.248 1.017 0 C-N-CA 124.664 1.186 . . . . 52.31 112.52 -176.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.415 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 14.8 ptmm? -68.1 -35.8 78.74 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 115.564 -0.744 . . . . 71.31 110.854 -175.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 38.9 mm-40 -62.5 -40.09 95.58 Favored 'General case' 0 C--N 1.353 0.727 0 O-C-N 123.772 0.67 . . . . 74.14 111.25 179.191 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.525 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 13.9 mmmm -64.45 -40.14 95.16 Favored 'General case' 0 CA--C 1.551 1.008 0 O-C-N 123.425 0.453 . . . . 74.1 110.85 178.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.497 HD23 ' NE2' ' A' ' 22' ' ' GLN . 81.9 mt -71.74 -29.47 64.56 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.98 0.912 . . . . 71.25 112.42 177.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 90.4 mt -73.63 -33.72 64.67 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.44 0.696 . . . . 73.51 110.256 175.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 50.0 mt-10 -66.63 -31.75 72.63 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.527 0.731 . . . . 64.02 110.776 173.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.497 ' NE2' HD23 ' A' ' 19' ' ' LEU . 48.7 mt-30 -77.56 -41.14 40.03 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.324 0.65 . . . . 65.1 111.587 176.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.0 t -144.7 88.78 6.92 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 122.788 0.435 . . . . 75.44 110.085 -176.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -75.46 -15.93 19.48 Favored 'Trans proline' 0 C--N 1.38 2.202 0 C-N-CA 123.393 2.729 . . . . 54.23 113.153 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -81.79 -13.86 57.16 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.39 0.676 . . . . 72.01 110.601 174.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 67.2 m -98.11 137.56 36.7 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.241 0.617 . . . . 51.24 110.521 176.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -84.72 117.17 23.65 Favored 'General case' 0 C--O 1.243 0.724 0 N-CA-C 107.808 -1.182 . . . . 74.44 107.808 166.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 66.5 t -99.21 112.43 31.39 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 O-C-N 123.501 0.501 . . . . 74.14 109.876 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -97.62 178.01 5.31 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.01 0.924 . . . . 74.32 108.897 174.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.2 p -105.99 125.52 61.52 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 N-CA-C 109.624 -0.51 . . . . 74.01 109.624 173.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.8 tpt180 -83.08 -59.03 2.61 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 109.281 -0.636 . . . . 55.33 109.281 178.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 21.5 mtm180 -146.14 166.31 26.54 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.466 1.106 . . . . 74.14 109.74 176.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.554 HG11 ' HG3' ' A' ' 8' ' ' LYS . 60.9 t -130.02 111.59 21.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 N-CA-C 107.401 -1.333 . . . . 43.5 107.401 176.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 24.8 tp60 -107.41 109.93 21.77 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 118.008 0.367 . . . . 72.01 110.185 -177.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -78.29 137.14 37.93 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 108.626 -0.879 . . . . 65.32 108.626 170.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -143.55 82.65 1.74 Allowed 'General case' 0 C--O 1.242 0.662 0 N-CA-C 108.593 -0.892 . . . . 63.13 108.593 -177.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.54 -79.11 0.82 Allowed Glycine 0 C--N 1.348 1.242 0 CA-C-N 115.443 -0.799 . . . . 45.22 112.565 -178.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -131.98 -18.38 2.67 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.108 0.963 . . . . 72.01 110.994 174.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.511 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 7.0 m -85.21 116.74 23.74 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 122.78 0.432 . . . . 75.1 109.889 177.605 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.61 HD12 HG21 ' A' ' 11' ' ' VAL . 32.4 mt -91.0 106.35 17.44 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 N-CA-C 108.988 -0.745 . . . . 61.13 108.988 169.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 35.2 mtp180 -89.06 94.46 9.95 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 108.11 -1.07 . . . . 74.22 108.11 175.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.3 t -85.97 114.52 25.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 N-CA-C 108.971 -0.752 . . . . 72.31 108.971 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -84.12 109.63 17.86 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 108.024 -1.102 . . . . 73.24 108.024 172.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.5 mp -104.04 169.08 8.71 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 122.974 0.509 . . . . 50.13 110.286 177.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 57.8 tt0 -121.2 105.29 10.44 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.174 0.989 . . . . 75.44 109.151 -175.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.2 tt -101.09 110.79 22.85 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 108.102 -1.073 . . . . 74.24 108.102 -177.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 72.4 mtt180 . . . . . 0 N--CA 1.478 0.967 0 C-N-CA 122.756 0.423 . . . . 74.53 110.806 -175.069 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt . . . . . 0 N--CA 1.474 0.765 0 N-CA-C 110.057 -0.349 . . . . 64.44 110.057 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -139.77 118.73 12.56 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 108.483 -0.932 . . . . 55.54 108.483 175.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -88.57 138.45 31.42 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 122.791 0.436 . . . . 73.31 111.355 -175.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -123.8 119.41 29.63 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.565 0.746 . . . . 75.43 109.209 178.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 28.2 m -86.42 100.13 12.13 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 109.391 -0.596 . . . . 74.1 109.391 175.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.467 HG22 HG23 ' A' ' 71' ' ' ILE . 45.9 t -93.31 104.21 15.49 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 N-CA-C 107.48 -1.304 . . . . 71.0 107.48 179.411 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -84.74 101.72 12.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.717 -1.129 . . . . 73.2 108.864 -176.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.538 ' HB ' HG13 ' A' ' 11' ' ' VAL . 21.6 t -106.65 111.26 34.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 124.067 0.947 . . . . 63.23 108.517 177.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.511 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 33.8 tt0 -100.97 150.13 23.2 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.523 0.729 . . . . 55.12 110.54 -175.165 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -68.16 106.28 2.36 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.355 0.662 . . . . 65.33 109.653 174.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 56.0 tp60 -92.83 85.96 5.35 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 108.43 -0.952 . . . . 73.35 108.43 173.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.02 -98.47 0.56 Allowed Glycine 0 C--N 1.348 1.244 0 N-CA-C 111.335 -0.706 . . . . 55.34 111.335 -174.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -101.53 -34.69 9.44 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.076 0.95 . . . . 72.04 109.98 176.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 65.0 p -84.87 175.97 8.78 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.827 0.851 . . . . 75.13 111.956 -174.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -114.05 139.39 49.33 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.565 1.146 . . . . 71.54 109.895 176.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 8.8 t -133.27 132.53 41.52 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.623 0.769 . . . . 73.44 110.109 -179.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.432 HG22 HG22 ' A' ' 59' ' ' VAL . 88.8 t -74.77 106.83 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 108.823 -0.806 . . . . 72.54 108.823 173.311 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 2.9 mmmp? -63.46 -52.03 63.16 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.689 1.196 . . . . 73.33 109.857 175.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 19.1 tpt180 -175.67 144.43 0.65 Allowed 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.105 -0.952 . . . . 75.11 109.675 178.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.467 HG23 HG22 ' A' ' 57' ' ' VAL . 35.6 mt -88.38 110.56 21.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 N-CA-C 108.194 -1.039 . . . . 53.45 108.194 168.32 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 30.7 m -91.96 106.98 18.88 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.99 -0.745 . . . . 75.3 108.99 177.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 52.6 ttt180 -68.82 129.44 39.95 Favored 'General case' 0 C--O 1.244 0.816 0 N-CA-C 108.23 -1.026 . . . . 70.21 108.23 169.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 15.3 t . . . . . 0 C--O 1.246 0.889 0 O-C-N 123.774 0.671 . . . . 62.33 110.857 -179.683 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 . . . . . 0 CA--C 1.546 0.794 0 N-CA-C 111.209 0.077 . . . . 73.3 111.209 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.412 ' O ' HG23 ' A' ' 11' ' ' VAL . 52.0 mt-10 -48.11 -53.57 16.17 Favored 'General case' 0 C--N 1.363 1.179 0 C-N-CA 124.074 0.949 . . . . 63.45 110.127 173.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.527 ' HG3' HG11 ' A' ' 33' ' ' VAL . 0.4 OUTLIER -56.22 -45.09 80.06 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 124.905 1.378 . . . . 74.51 109.732 -175.898 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -62.89 -38.12 89.63 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.97 0.908 . . . . 75.02 111.356 -177.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -75.02 -44.58 47.17 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.698 0.799 . . . . 55.01 110.9 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.441 HG11 ' HB ' ' A' ' 40' ' ' ILE . 90.6 t -76.41 -32.76 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.179 0.992 . . . . 63.14 112.301 -169.166 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.409 ' HG3' ' O ' ' A' ' 8' ' ' LYS . 9.1 mtmp? -61.32 -37.92 85.0 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 109.685 -0.487 . . . . 74.45 109.685 173.009 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.535 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 7.8 tt0 -67.54 -52.08 43.16 Favored 'General case' 0 C--N 1.352 0.717 0 O-C-N 124.248 0.968 . . . . 71.34 110.123 176.025 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.463 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 72.2 t -54.97 -39.88 51.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 123.223 0.609 . . . . 73.14 110.62 179.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.426 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -66.62 -48.42 69.55 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 115.363 -0.835 . . . . 74.11 112.078 -178.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -71.34 -34.9 70.94 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 123.713 0.633 . . . . 72.23 111.769 -174.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.535 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 20.7 mm-40 -61.63 -43.4 98.92 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 123.404 0.44 . . . . 62.32 110.623 -179.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.573 ' HG3' HG21 ' A' ' 68' ' ' VAL . 2.2 mmmp? -64.18 -42.79 96.55 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 123.759 0.662 . . . . 73.42 110.011 178.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.499 ' HB3' HD12 ' A' ' 46' ' ' LEU . 40.5 mt -63.0 -34.89 78.52 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.76 0.824 . . . . 75.32 112.563 177.515 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 85.1 mt -77.21 -26.41 52.7 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.389 0.676 . . . . 74.21 111.62 -177.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 12.5 mm-40 -69.87 -36.62 75.63 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 109.909 -0.404 . . . . 74.4 109.909 171.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -77.28 -31.37 54.77 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.312 1.045 . . . . 71.02 111.462 178.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.9 m -146.28 83.15 8.61 Favored Pre-proline 0 CA--C 1.56 1.35 0 C-N-CA 123.705 0.802 . . . . 72.14 109.935 -174.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -75.71 -21.26 14.75 Favored 'Trans proline' 0 C--N 1.375 1.951 0 C-N-CA 123.138 2.558 . . . . 64.41 112.127 177.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -86.57 15.28 5.71 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.326 1.05 . . . . 53.4 111.18 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 46.9 t -120.2 152.78 37.21 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.476 0.711 . . . . 62.11 111.207 -176.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.89 108.96 20.73 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 107.73 -1.211 . . . . 75.02 107.73 174.339 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.3 t -97.46 116.83 40.92 Favored 'Isoleucine or valine' 0 C--O 1.239 0.552 0 C-N-CA 123.508 0.723 . . . . 71.01 110.061 -176.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -101.59 161.94 13.27 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.578 1.151 . . . . 74.22 108.345 171.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 59.2 t -87.48 113.85 25.48 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 N-CA-C 107.834 -1.173 . . . . 51.42 107.834 169.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -81.89 -45.27 15.7 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.397 0.679 . . . . 63.4 110.111 -176.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 29.8 tpt180 -167.66 157.01 10.01 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 124.03 0.932 . . . . 65.14 109.145 177.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.527 HG11 ' HG3' ' A' ' 8' ' ' LYS . 58.0 t -120.87 130.58 74.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 123.464 0.706 . . . . 74.04 109.374 176.256 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.678 ' HB3' HE21 ' A' ' 36' ' ' GLN . 84.2 mm-40 -119.62 112.18 19.0 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.728 0.811 . . . . 75.13 109.706 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.549 ' HG2' HG12 ' A' ' 40' ' ' ILE . 3.6 tmtp? -92.06 107.4 19.18 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 106.747 -1.575 . . . . 74.01 106.747 173.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.678 HE21 ' HB3' ' A' ' 34' ' ' GLN . 83.6 mm-40 -119.55 101.58 8.03 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 108.522 -0.918 . . . . 75.5 108.522 -174.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.19 -93.72 0.52 Allowed Glycine 0 C--N 1.348 1.242 0 O-C-N 123.585 0.553 . . . . 40.33 112.488 -176.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -135.55 5.86 3.2 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.343 1.057 . . . . 64.03 109.26 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 69.3 m -118.67 116.16 26.01 Favored 'General case' 0 C--O 1.241 0.628 0 C-N-CA 124.69 1.196 . . . . 74.13 109.621 -177.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.549 HG12 ' HG2' ' A' ' 35' ' ' LYS . 35.0 mt -88.8 108.14 18.59 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-O 121.037 0.446 . . . . 75.01 110.119 178.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -86.17 95.22 9.5 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.403 1.081 . . . . 74.23 108.172 174.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 25.9 t -85.46 122.92 38.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 N-CA-C 109.13 -0.692 . . . . 61.33 109.13 178.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -87.24 121.21 29.39 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 108.007 -1.109 . . . . 75.13 108.007 170.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.8 mp -120.08 151.2 39.39 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-O 121.122 0.486 . . . . 73.12 109.917 179.289 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.507 ' HG3' ' HG3' ' A' ' 52' ' ' LYS . 39.3 tt0 -106.31 102.5 11.9 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 107.77 -1.196 . . . . 42.14 107.77 -179.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.499 HD12 ' HB3' ' A' ' 19' ' ' LEU . 8.8 tt -102.0 112.16 24.7 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.146 -1.057 . . . . 73.5 108.146 -174.558 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 . . . . . 0 N--CA 1.478 0.957 0 C-N-CA 123.273 0.629 . . . . 72.32 110.181 -169.513 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.509 ' HG2' HD21 ' A' ' 54' ' ' ASN . 39.8 ttmt . . . . . 0 C--O 1.245 0.838 0 N-CA-C 108.259 -1.015 . . . . 72.21 108.259 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -102.37 112.53 25.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.975 -1.011 . . . . 73.24 108.451 179.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.509 HD21 ' HG2' ' A' ' 52' ' ' LYS . 0.8 OUTLIER -92.0 115.2 27.86 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 109.058 -0.719 . . . . 63.1 109.058 -177.038 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -108.45 121.1 44.25 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.627 0.771 . . . . 55.11 109.359 179.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 35.0 m -90.93 100.83 13.62 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 108.265 -1.013 . . . . 73.23 108.265 169.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.448 HG13 HG12 ' A' ' 71' ' ' ILE . 47.3 t -93.66 103.41 14.66 Favored 'Isoleucine or valine' 0 C--O 1.241 0.656 0 N-CA-C 107.326 -1.361 . . . . 75.25 107.326 177.369 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -87.59 100.8 13.06 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.439 -0.8 . . . . 73.23 108.871 -176.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.446 HG22 HG22 ' A' ' 68' ' ' VAL . 25.5 t -104.45 116.1 47.62 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 124.113 0.965 . . . . 63.11 109.165 -177.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -100.78 143.53 30.83 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.246 1.018 . . . . 63.51 109.947 -175.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.7 tpp180 -71.36 134.19 46.52 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.163 0.585 . . . . 62.42 110.602 176.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -133.05 89.84 2.67 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 108.274 -1.01 . . . . 61.12 108.274 172.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 68.26 -111.26 3.89 Favored Glycine 0 C--N 1.35 1.323 0 CA-C-N 114.813 -1.085 . . . . 73.34 112.325 -177.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -92.26 -25.68 18.5 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.287 0.635 . . . . 74.11 111.089 178.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 22.9 p -99.12 175.76 5.79 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.917 0.887 . . . . 75.22 111.847 -175.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -123.57 158.52 31.22 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.522 1.129 . . . . 62.35 109.761 179.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 9.0 t -145.46 135.3 23.55 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.494 0.318 . . . . 72.2 110.725 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.573 HG21 ' HG3' ' A' ' 18' ' ' LYS . 91.3 t -77.86 115.47 19.89 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 N-CA-C 109.227 -0.657 . . . . 44.43 109.227 173.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -80.92 -41.89 22.24 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 123.24 0.616 . . . . 75.22 110.632 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -165.38 144.35 6.42 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 123.462 0.705 . . . . 73.35 110.261 175.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.448 HG12 HG13 ' A' ' 57' ' ' VAL . 41.8 mt -104.25 107.66 22.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 N-CA-C 108.027 -1.101 . . . . 63.03 108.027 168.322 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.0 m -107.76 108.39 19.58 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.204 0.602 . . . . 74.14 109.676 -178.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 -79.29 150.01 31.63 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 109.579 -0.526 . . . . 74.12 109.579 172.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.3 t . . . . . 0 CA--C 1.554 1.12 0 CA-C-N 115.656 -0.702 . . . . 63.13 109.951 172.544 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.479 ' HG3' HE21 ' A' ' 10' ' ' GLN . 13.2 tp10 . . . . . 0 N--CA 1.469 0.479 0 N-CA-C 110.085 -0.339 . . . . 74.4 110.085 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.555 ' O ' HG23 ' A' ' 11' ' ' VAL . 39.9 mm-40 -55.04 -45.91 75.26 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 124.258 0.974 . . . . 74.24 111.895 175.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -62.2 -36.57 82.33 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 122.898 0.479 . . . . 74.01 111.389 -178.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.405 ' HA ' ' HE3' ' A' ' 12' ' ' LYS . 43.5 mtp180 -63.73 -38.96 93.05 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 115.557 -0.747 . . . . 74.44 109.797 179.172 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.479 HE21 ' HG3' ' A' ' 6' ' ' GLU . 58.0 mt-30 -66.59 -40.93 89.13 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 114.753 -1.112 . . . . 73.12 110.875 176.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 7' ' ' GLU . 63.0 t -61.05 -44.78 98.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 123.434 0.694 . . . . 71.54 111.9 -175.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.405 ' HE3' ' HA ' ' A' ' 9' ' ' ARG . 10.1 mtmp? -60.92 -32.69 72.17 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 123.732 0.645 . . . . 72.45 110.724 179.65 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.511 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.9 tt0 -71.68 -53.78 12.45 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 115.361 -0.836 . . . . 70.33 110.323 176.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.402 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 98.5 t -53.91 -36.27 30.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 C-N-CA 123.598 0.759 . . . . 72.34 110.759 179.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.466 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -66.85 -50.95 60.9 Favored 'General case' 0 C--O 1.247 0.924 0 CA-C-N 114.795 -1.093 . . . . 43.25 111.454 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.45 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 20.5 ptmt -69.46 -33.08 72.38 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 116.18 -0.464 . . . . 73.23 111.925 -175.133 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.511 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 19.3 mm-40 -61.86 -43.0 99.72 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 123.691 0.619 . . . . 72.45 110.122 -179.114 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.432 ' HG3' HG21 ' A' ' 68' ' ' VAL . 14.9 mmmm -73.88 -22.43 59.73 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 115.603 -0.726 . . . . 62.15 111.143 -178.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 57.9 mt -73.9 -36.22 64.73 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 122.852 0.461 . . . . 65.34 111.541 169.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 83.6 mt -66.12 -32.15 73.44 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.627 0.771 . . . . 63.45 110.77 178.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -57.19 -41.31 79.08 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.918 0.887 . . . . 71.33 110.962 174.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.496 HE22 HG21 ' A' ' 71' ' ' ILE . 46.9 mt-30 -80.75 -51.72 8.34 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.488 -0.778 . . . . 73.2 110.824 -177.003 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 27.1 t -131.11 89.4 42.14 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 123.277 0.631 . . . . 64.13 109.927 -175.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -80.06 -1.93 11.73 Favored 'Trans proline' 0 C--N 1.375 1.965 0 C-N-CA 122.989 2.459 . . . . 73.41 112.592 174.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -86.56 6.55 30.19 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.964 0.906 . . . . 75.31 111.832 -178.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 21.5 p -143.72 141.98 30.73 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.514 0.726 . . . . 65.22 110.644 -171.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -86.72 136.63 32.94 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 108.342 -0.985 . . . . 72.53 108.342 174.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.508 HG22 HD12 ' A' ' 46' ' ' LEU . 40.7 t -98.61 117.18 43.21 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 C-N-CA 123.114 0.566 . . . . 73.45 110.236 -174.069 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 54.4 tp60 -91.71 147.57 22.9 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.806 1.243 . . . . 75.21 109.168 175.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 79.9 t -87.92 121.2 38.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 N-CA-C 108.343 -0.984 . . . . 61.54 108.343 170.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.3 tpt180 -94.72 -59.62 1.88 Allowed 'General case' 0 N--CA 1.477 0.88 0 O-C-N 123.295 0.372 . . . . 74.31 110.242 -178.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 50.3 mtt180 -148.53 165.2 31.93 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 124.321 1.048 . . . . 73.43 110.166 -179.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 82.0 t -137.16 132.78 46.87 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 C-N-CA 124.346 1.059 . . . . 73.24 109.127 178.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.414 ' HB2' ' HB2' ' A' ' 41' ' ' ARG . 69.2 mm-40 -125.46 108.57 11.76 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.332 1.053 . . . . 73.5 108.814 -177.213 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.5 tmtt? -92.87 106.92 18.81 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 108.042 -1.096 . . . . 70.2 108.042 -176.636 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.2 mm-40 -120.51 89.01 3.04 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.443 0.697 . . . . 73.33 109.791 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.6 -98.58 0.41 Allowed Glycine 0 C--N 1.35 1.339 0 CA-C-N 115.598 -0.728 . . . . 72.33 112.501 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.455 HD22 ' HB3' ' A' ' 61' ' ' ARG . 16.7 m120 -105.87 -26.16 11.84 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.738 0.815 . . . . 70.12 110.349 175.125 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 25.1 m -87.77 98.68 11.59 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.406 0.683 . . . . 74.31 110.475 -177.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.523 HD12 HG21 ' A' ' 11' ' ' VAL . 40.1 mt -90.12 108.47 19.51 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 CA-C-N 116.085 -0.507 . . . . 72.35 109.867 171.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.584 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 91.6 mtt180 -84.12 105.8 15.27 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.402 1.081 . . . . 65.04 109.388 174.44 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.1 t -95.19 118.94 42.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 N-CA-C 108.721 -0.844 . . . . 54.24 108.721 174.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -83.74 115.24 22.11 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 107.992 -1.114 . . . . 75.13 107.992 168.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.445 HD11 ' HB1' ' A' ' 15' ' ' ALA . 2.7 mp -108.71 170.83 7.78 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.887 -0.783 . . . . 53.5 108.887 174.355 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -135.75 107.68 7.11 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.862 -0.792 . . . . 74.52 108.862 -168.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.508 HD12 HG22 ' A' ' 28' ' ' VAL . 9.2 tt -127.71 138.15 52.69 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.831 1.252 . . . . 75.44 108.697 -168.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 48.9 mtm105 . . . . . 0 N--CA 1.478 0.94 0 C-N-CA 122.828 0.451 . . . . 72.04 110.923 -175.421 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.543 0.701 0 N-CA-C 108.209 -1.034 . . . . 53.44 108.209 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -120.51 127.82 52.54 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.773 1.229 . . . . 74.22 109.091 178.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -88.58 130.02 35.35 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 109.163 -0.681 . . . . 73.33 109.163 175.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -114.22 118.71 34.74 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 109.279 -0.637 . . . . 72.45 109.279 178.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 38.4 m -86.16 100.7 12.4 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 108.458 -0.942 . . . . 75.42 108.458 172.367 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.466 HG11 ' HA ' ' A' ' 15' ' ' ALA . 60.1 t -92.91 106.52 18.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 N-CA-C 108.411 -0.959 . . . . 72.45 108.411 178.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.584 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 33.1 mt-10 -77.31 107.6 9.83 Favored 'General case' 0 C--O 1.222 -0.353 0 N-CA-C 108.056 -1.09 . . . . 63.51 108.056 178.213 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.521 HG22 HG22 ' A' ' 68' ' ' VAL . 38.8 t -112.14 124.38 68.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 N-CA-C 109.006 -0.739 . . . . 72.42 109.006 176.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -112.92 147.51 36.92 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.499 0.719 . . . . 72.24 110.128 -177.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.455 ' HB3' HD22 ' A' ' 38' ' ' ASN . 9.8 tpt180 -74.96 106.78 6.63 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.372 -0.831 . . . . 75.23 110.357 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 22.7 tp60 -91.22 79.12 5.73 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 108.388 -0.968 . . . . 75.0 108.388 174.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 73.24 -100.53 1.05 Allowed Glycine 0 C--N 1.348 1.215 0 CA-C-N 114.986 -1.006 . . . . 74.33 112.366 -179.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -95.0 -32.2 13.26 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.142 0.977 . . . . 52.12 110.265 176.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.8 p -96.08 176.46 6.08 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.687 0.795 . . . . 63.11 111.358 -175.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . 0.427 ' HZ2' ' HB3' ' A' ' 7' ' ' GLU . 96.3 m95 -119.08 149.07 42.3 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.844 1.258 . . . . 72.5 109.934 179.21 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 14.9 t -147.92 140.19 24.31 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.276 0.63 . . . . 65.32 110.281 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.521 HG22 HG22 ' A' ' 59' ' ' VAL . 76.4 t -80.78 114.15 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 123.047 0.539 . . . . 72.24 110.815 -177.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -65.41 -54.75 24.18 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.743 1.217 . . . . 74.41 110.85 175.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 2.3 tpm_? -163.36 132.18 3.92 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.608 -0.723 . . . . 74.23 110.012 -178.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.496 HG21 HE22 ' A' ' 22' ' ' GLN . 63.5 mt -87.76 107.4 17.29 Favored 'Isoleucine or valine' 0 C--O 1.24 0.568 0 N-CA-C 107.828 -1.175 . . . . 64.54 107.828 167.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 22.2 m -98.48 115.5 28.68 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.112 -0.949 . . . . 74.43 108.773 -178.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 11.8 ttm180 -69.49 149.31 48.4 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 108.883 -0.784 . . . . 75.31 108.883 171.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 8.1 t . . . . . 0 C--O 1.245 0.867 0 C-N-CA 123.0 0.52 . . . . 73.44 110.307 173.495 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 . . . . . 0 N--CA 1.48 1.046 0 N-CA-C 111.822 0.305 . . . . 64.4 111.822 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -46.28 -53.23 11.11 Favored 'General case' 0 C--O 1.209 -1.037 0 C-N-CA 123.764 0.825 . . . . 74.52 109.948 165.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.658 ' HG3' HG11 ' A' ' 33' ' ' VAL . 1.1 mptm? -58.57 -45.34 89.2 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.312 1.045 . . . . 75.14 111.208 179.478 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 28.3 mmm180 -55.97 -42.24 75.98 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.857 0.863 . . . . 74.34 110.881 -177.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -78.57 -55.13 5.44 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 114.773 -1.103 . . . . 52.34 111.34 -178.302 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.426 HG12 HG21 ' A' ' 42' ' ' VAL . 73.9 t -65.81 -37.58 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 124.842 1.257 . . . . 73.24 113.218 -166.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.473 ' HD2' HG21 ' A' ' 30' ' ' VAL . 22.3 mtmm -64.01 -38.12 89.92 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-N 118.163 0.438 . . . . 75.41 109.903 178.463 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.537 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.5 tt0 -69.05 -45.53 70.18 Favored 'General case' 0 C--N 1.352 0.679 0 CA-C-N 115.349 -0.841 . . . . 64.44 110.494 178.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.484 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 92.8 t -60.19 -41.51 86.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 123.228 0.611 . . . . 73.44 109.99 177.205 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.76 -39.08 76.92 Favored 'General case' 0 C--O 1.244 0.769 0 C-N-CA 124.213 1.005 . . . . 75.51 111.927 -176.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.454 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 21.6 ptmt -71.87 -30.89 65.9 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 119.297 -0.383 . . . . 43.54 110.566 -179.128 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 24.4 mm-40 -61.91 -41.77 98.31 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 123.609 0.568 . . . . 74.44 110.4 174.232 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.648 ' HB3' HD11 ' A' ' 71' ' ' ILE . 2.1 mmmp? -61.41 -36.54 80.6 Favored 'General case' 0 CA--C 1.55 0.948 0 O-C-N 124.048 0.842 . . . . 73.34 110.507 178.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.593 ' HB3' HD12 ' A' ' 46' ' ' LEU . 52.0 mt -76.07 -31.91 59.0 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.788 0.835 . . . . 73.33 112.436 177.276 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 93.3 mt -73.11 -25.44 60.86 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.987 0.515 . . . . 62.44 110.902 178.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 49.5 mt-10 -65.11 -42.71 93.71 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-O 121.293 0.568 . . . . 73.1 110.149 171.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -71.37 -36.3 71.4 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 115.044 -0.98 . . . . 71.53 111.238 178.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.2 t -148.88 89.75 4.91 Favored Pre-proline 0 CA--C 1.544 0.716 0 CA-C-N 115.836 -0.62 . . . . 71.24 109.688 -175.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -70.37 -17.46 34.78 Favored 'Trans proline' 0 C--N 1.377 2.034 0 C-N-CA 122.828 2.352 . . . . 61.23 111.609 172.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -79.59 -10.73 59.85 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.338 1.055 . . . . 61.43 112.099 -176.315 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 68.7 p -104.8 157.0 17.5 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.514 0.726 . . . . 72.1 111.672 -178.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.504 ' HE3' ' HA ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -102.86 124.18 47.91 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 108.353 -0.98 . . . . 62.42 108.353 164.626 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.402 HG11 HD12 ' A' ' 19' ' ' LEU . 49.4 t -101.4 114.22 39.96 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 123.796 0.838 . . . . 72.54 109.958 -178.363 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -93.53 165.11 12.91 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 124.322 1.049 . . . . 74.31 108.693 171.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.473 HG21 ' HD2' ' A' ' 12' ' ' LYS . 4.0 p -81.92 132.5 31.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 N-CA-C 109.0 -0.741 . . . . 60.21 109.0 165.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 -100.93 -44.21 5.82 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.362 0.665 . . . . 72.2 109.933 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -167.67 151.02 6.11 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 108.024 -1.102 . . . . 64.22 108.024 -175.039 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.658 HG11 ' HG3' ' A' ' 8' ' ' LYS . 65.8 t -129.62 130.77 67.11 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 123.487 0.715 . . . . 60.33 109.297 176.163 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -121.88 108.11 13.07 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.06 0.944 . . . . 70.11 109.801 177.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -92.17 109.68 21.05 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 108.395 -0.965 . . . . 74.34 108.395 171.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -122.52 90.13 3.24 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.768 0.827 . . . . 64.44 109.598 -178.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.26 -85.38 0.1 Allowed Glycine 0 C--N 1.348 1.2 0 CA-C-N 115.78 -0.645 . . . . 54.53 114.218 173.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -118.2 4.44 11.95 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 124.303 1.041 . . . . 64.0 111.869 -176.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 47.5 m -142.18 119.47 11.51 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.815 0.446 . . . . 62.15 111.043 -174.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.405 HD12 HG21 ' A' ' 11' ' ' VAL . 24.5 mt -94.75 108.12 20.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 123.171 0.588 . . . . 53.14 109.758 171.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 11.9 mtm180 -90.12 99.98 12.89 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 107.365 -1.346 . . . . 73.25 107.365 174.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.439 HG13 HG22 ' A' ' 33' ' ' VAL . 40.5 t -91.07 116.53 32.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 N-CA-C 108.911 -0.774 . . . . 75.35 108.911 178.228 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -79.15 127.04 31.52 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 107.652 -1.24 . . . . 74.31 107.652 167.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.8 mp -124.22 154.42 40.18 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 109.386 -0.598 . . . . 73.4 109.386 177.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -107.27 104.5 14.13 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 108.932 -0.766 . . . . 74.43 108.932 -177.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.593 HD12 ' HB3' ' A' ' 19' ' ' LEU . 9.5 tt -100.76 126.53 47.32 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 108.244 -1.021 . . . . 64.21 108.244 -178.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 . . . . . 0 N--CA 1.485 1.282 0 C-N-CA 122.884 0.473 . . . . 74.14 110.949 -173.672 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt . . . . . 0 N--CA 1.468 0.468 0 N-CA-C 109.313 -0.625 . . . . 72.52 109.313 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -145.29 127.87 16.1 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 108.597 -0.89 . . . . 62.04 108.597 174.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.467 ' N ' HD22 ' A' ' 54' ' ' ASN . 0.7 OUTLIER -86.85 143.04 27.63 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.975 0.91 . . . . 63.51 109.3 -178.529 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -132.07 120.25 22.11 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.018 0.527 . . . . 72.43 110.007 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 91.0 m -84.98 100.29 11.56 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 108.825 -0.805 . . . . 62.11 108.825 170.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 71.2 t -93.02 103.86 15.12 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 N-CA-C 107.047 -1.464 . . . . 71.24 107.047 174.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.434 ' HB2' ' HB2' ' A' ' 69' ' ' LYS . 41.1 mt-10 -79.41 114.58 18.46 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 114.917 -1.038 . . . . 75.34 108.583 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.4 HG22 HG22 ' A' ' 68' ' ' VAL . 44.5 t -115.73 122.2 68.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 124.047 0.939 . . . . 62.44 108.61 177.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.474 ' HB2' ' HD3' ' A' ' 69' ' ' LYS . 35.9 tt0 -100.59 144.68 29.28 Favored 'General case' 0 C--O 1.241 0.653 0 C-N-CA 124.426 1.09 . . . . 75.12 109.827 -173.399 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 26.0 tpt180 -80.73 105.5 12.01 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.388 0.675 . . . . 74.53 109.447 174.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -108.12 89.47 3.01 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.375 1.07 . . . . 73.41 108.208 179.079 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 71.0 -107.51 2.19 Favored Glycine 0 CA--C 1.529 0.965 0 N-CA-C 111.693 -0.563 . . . . 71.44 111.693 -174.302 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -113.6 -3.57 13.6 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.882 0.873 . . . . 73.43 109.99 174.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 32.8 p -99.02 172.55 7.33 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.329 0.585 . . . . 74.3 111.096 176.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -119.49 140.72 50.02 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.876 1.27 . . . . 71.04 109.227 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 9.0 t -140.28 124.32 17.54 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 121.196 0.522 . . . . 73.32 110.453 -178.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.4 HG22 HG22 ' A' ' 59' ' ' VAL . 90.0 t -75.28 114.36 15.24 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 C-N-CA 123.287 0.635 . . . . 65.1 110.17 -177.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.474 ' HD3' ' HB2' ' A' ' 60' ' ' GLU . 32.1 mmmt -64.93 -50.4 66.61 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.626 1.171 . . . . 52.21 110.43 176.208 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -170.37 165.1 8.8 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 124.508 1.13 . . . . 72.45 110.035 175.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.648 HD11 ' HB3' ' A' ' 18' ' ' LYS . 75.1 mt -101.44 107.22 20.99 Favored 'Isoleucine or valine' 0 C--O 1.24 0.593 0 N-CA-C 107.491 -1.299 . . . . 70.42 107.491 166.038 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 12.3 m -92.87 114.58 27.18 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 109.299 -0.63 . . . . 75.11 109.299 -178.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 -68.05 141.47 56.16 Favored 'General case' 0 C--O 1.245 0.816 0 N-CA-C 109.037 -0.727 . . . . 72.45 109.037 169.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.5 t . . . . . 0 C--O 1.245 0.845 0 N-CA-C 109.112 -0.699 . . . . 71.21 109.112 173.993 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 . . . . . 0 CA--C 1.535 0.38 0 CA-C-O 119.664 -0.208 . . . . 73.23 111.138 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -56.69 -44.08 81.13 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.333 0.653 . . . . 54.12 110.309 174.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.4 ' O ' ' HG3' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -64.67 -45.47 86.58 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 124.059 0.849 . . . . 75.03 108.977 177.592 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 21.7 mtm180 -58.25 -40.02 80.68 Favored 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 123.866 0.866 . . . . 75.54 111.649 -178.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -67.57 -55.12 14.66 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.128 0.971 . . . . 74.01 110.314 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.602 HG21 HD12 ' A' ' 40' ' ' ILE . 72.4 t -64.97 -36.31 77.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 123.811 0.844 . . . . 74.4 112.436 -172.504 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 8' ' ' LYS . 10.3 mtmp? -65.4 -42.63 92.39 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.658 0.383 . . . . 72.11 110.26 176.362 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.501 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.2 tt0 -66.09 -49.29 68.1 Favored 'General case' 0 C--N 1.352 0.691 0 O-C-N 123.866 0.729 . . . . 64.11 110.217 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.484 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 84.6 t -57.87 -46.23 87.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 123.232 0.613 . . . . 74.43 109.862 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.449 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -60.25 -51.61 68.84 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.77 0.828 . . . . 52.03 112.295 -178.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -63.4 -39.5 94.67 Favored 'General case' 0 C--N 1.351 0.633 0 O-C-N 123.924 0.765 . . . . 73.32 110.406 -178.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 33.4 mm-40 -66.59 -40.66 89.0 Favored 'General case' 0 C--N 1.353 0.748 0 O-C-N 123.409 0.443 . . . . 73.53 110.975 178.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.484 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 73.4 mmtt -64.17 -35.31 80.38 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.484 0.714 . . . . 64.43 110.95 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.614 ' HB3' HD12 ' A' ' 46' ' ' LEU . 61.5 mt -75.5 -30.44 59.85 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.627 -0.715 . . . . 75.11 111.545 175.686 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.0 mt -73.29 -28.4 62.09 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.523 0.729 . . . . 72.5 110.978 174.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 24.4 mm-40 -59.24 -36.35 75.29 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 123.29 0.636 . . . . 75.32 110.172 174.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -91.83 -30.4 16.22 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 114.444 -1.253 . . . . 61.44 111.199 -175.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.2 t -148.81 88.33 5.24 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 122.82 0.448 . . . . 52.14 110.685 -175.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -76.04 -20.91 14.46 Favored 'Trans proline' 0 C--N 1.383 2.359 0 C-N-CA 123.155 2.57 . . . . 75.42 113.367 178.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -78.31 -13.18 59.96 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.346 0.658 . . . . 74.11 111.733 -176.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 54.0 p -105.87 135.5 47.18 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.577 0.751 . . . . 33.01 110.487 177.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -75.06 126.61 31.38 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 108.708 -0.849 . . . . 55.22 108.708 167.414 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 58.6 t -100.85 112.91 35.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 109.421 -0.585 . . . . 62.04 109.421 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.512 ' HB2' ' HB3' ' A' ' 45' ' ' GLU . 15.8 mm100 -100.0 123.76 44.61 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.909 1.284 . . . . 74.32 109.397 -178.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 p -64.88 115.78 3.52 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 N-CA-C 109.121 -0.696 . . . . 51.31 109.121 173.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 -96.53 -42.14 8.22 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.716 -0.675 . . . . 73.05 110.25 -171.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.473 ' HB3' ' HB2' ' A' ' 43' ' ' GLU . 60.6 ttt180 -154.71 143.79 21.05 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.463 0.705 . . . . 72.11 110.181 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.8 t -114.63 110.69 32.97 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 N-CA-C 107.982 -1.118 . . . . 71.23 107.982 173.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 23.7 tp60 -125.7 117.07 22.69 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 118.162 0.437 . . . . 61.23 111.308 -174.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.6 tppp? -78.23 134.66 37.55 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.905 0.882 . . . . 44.03 110.59 178.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.8 mm-40 -128.43 84.05 2.21 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.365 1.066 . . . . 73.53 108.331 170.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.43 -93.18 0.7 Allowed Glycine 0 C--N 1.35 1.344 0 CA-C-N 115.83 -0.623 . . . . 74.24 111.618 -175.312 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.498 ' HB3' ' HB3' ' A' ' 61' ' ' ARG . 3.9 m-20 -119.27 -13.07 9.34 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 123.557 0.743 . . . . 65.23 110.299 173.3 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.617 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 21.2 m -91.84 99.25 12.15 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 123.685 0.794 . . . . 72.04 110.177 -179.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.602 HD12 HG21 ' A' ' 11' ' ' VAL . 37.9 mt -76.55 107.77 8.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 N-CA-C 108.988 -0.745 . . . . 74.3 108.988 175.071 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.474 HH21 HG21 ' A' ' 56' ' ' THR . 54.0 mtp180 -83.68 95.4 8.37 Favored 'General case' 0 C--O 1.24 0.603 0 N-CA-C 107.508 -1.293 . . . . 73.22 107.508 169.133 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.419 HG21 ' HB2' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -85.02 123.31 39.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 N-CA-C 108.685 -0.857 . . . . 71.11 108.685 173.948 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.473 ' HB2' ' HB3' ' A' ' 32' ' ' ARG . 45.0 mt-10 -89.33 130.51 35.7 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 123.943 0.897 . . . . 63.23 108.748 170.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.2 mp -130.2 168.68 16.44 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.214 0.53 . . . . 72.24 110.108 179.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.512 ' HB3' ' HB2' ' A' ' 29' ' ' GLN . 31.1 tt0 -118.24 119.33 34.36 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 125.455 1.502 . . . . 72.31 108.508 -174.177 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.614 HD12 ' HB3' ' A' ' 19' ' ' LEU . 8.1 tt -133.36 129.85 38.01 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.077 -1.453 . . . . 75.14 107.077 -176.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 50.8 mtp180 . . . . . 0 CA--C 1.54 0.589 0 C-N-CA 123.147 0.579 . . . . 73.23 109.882 -175.827 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt . . . . . 0 N--CA 1.475 0.808 0 CA-C-O 120.69 0.281 . . . . 61.5 111.172 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.551 ' HG2' ' HD2' ' A' ' 73' ' ' ARG . 13.2 mp0 -105.11 143.37 33.38 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.055 0.942 . . . . 62.32 110.299 179.7 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -93.96 131.63 39.22 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 108.949 -0.76 . . . . 74.42 108.949 173.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.534 ' CE2' ' HB3' ' A' ' 46' ' ' LEU . 20.9 m-85 -120.44 121.45 38.55 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.535 0.734 . . . . 74.41 109.726 178.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.474 HG21 HH21 ' A' ' 41' ' ' ARG . 25.1 m -87.63 103.88 15.99 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.757 0.823 . . . . 33.51 109.455 173.56 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.449 HG11 ' HA ' ' A' ' 15' ' ' ALA . 48.9 t -93.74 105.26 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 N-CA-C 107.55 -1.278 . . . . 54.45 107.55 172.621 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -88.49 100.11 12.81 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 108.407 -0.961 . . . . 64.03 108.407 -177.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.573 HG22 HG22 ' A' ' 68' ' ' VAL . 29.1 t -104.03 118.92 51.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 123.792 0.837 . . . . 63.52 108.948 -178.63 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.617 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 31.0 tt0 -101.07 146.47 27.4 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.089 0.956 . . . . 64.3 110.114 -177.432 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.498 ' HB3' ' HB3' ' A' ' 38' ' ' ASN . 7.7 tpp180 -74.31 142.16 45.21 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 116.158 -0.474 . . . . 71.11 110.106 173.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -142.61 83.3 1.81 Allowed 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 108.123 -1.066 . . . . 71.21 108.123 175.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.21 -104.07 1.2 Allowed Glycine 0 C--N 1.345 1.08 0 CA-C-N 115.33 -0.85 . . . . 62.44 112.032 -176.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -101.84 -19.18 15.41 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.123 0.569 . . . . 62.14 111.091 179.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.6 t -100.25 172.9 6.88 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 122.869 0.468 . . . . 74.1 111.319 -176.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -123.08 120.96 34.83 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.605 1.162 . . . . 72.43 109.208 179.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.9 t -111.97 120.5 42.12 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 123.918 0.887 . . . . 72.41 110.484 179.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.573 HG22 HG22 ' A' ' 59' ' ' VAL . 58.9 t -74.81 120.18 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 N-CA-C 109.68 -0.489 . . . . 70.15 109.68 179.092 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.412 ' HA ' ' HE2' ' A' ' 69' ' ' LYS . 11.5 mmpt? -76.59 -55.59 5.38 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.394 1.077 . . . . 71.21 110.923 -179.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 23.2 ttt85 -163.68 125.73 2.46 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.687 -0.688 . . . . 75.3 110.412 -172.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.456 HD11 ' HB3' ' A' ' 18' ' ' LYS . 57.1 mt -93.35 131.05 41.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 N-CA-C 107.917 -1.142 . . . . 73.04 107.917 167.5 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 84.7 m -137.91 125.48 22.14 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 123.516 0.726 . . . . 61.24 109.689 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.551 ' HD2' ' HG2' ' A' ' 53' ' ' GLU . 36.7 ttp85 -75.37 144.65 42.19 Favored 'General case' 0 C--O 1.242 0.701 0 N-CA-C 108.43 -0.952 . . . . 72.14 108.43 170.126 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.3 t . . . . . 0 C--O 1.249 1.073 0 C-N-CA 123.478 0.711 . . . . 73.24 109.55 172.516 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 . . . . . 0 N--CA 1.479 1.005 0 N-CA-C 109.912 -0.403 . . . . 72.23 109.912 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.548 ' O ' HG23 ' A' ' 11' ' ' VAL . 29.6 mm-40 -67.48 -49.47 63.4 Favored 'General case' 0 C--N 1.35 0.599 0 CA-C-O 118.604 -0.712 . . . . 75.3 110.413 -179.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.68 ' HG3' HD13 ' A' ' 40' ' ' ILE . 4.0 mppt? -57.16 -37.33 71.92 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-N 118.228 0.467 . . . . 53.33 111.321 175.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.585 ' HA ' ' HE2' ' A' ' 12' ' ' LYS . 77.0 ttt180 -59.51 -43.53 93.37 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 123.642 0.589 . . . . 75.05 110.772 177.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.484 ' O ' HG23 ' A' ' 14' ' ' VAL . 48.8 mt-30 -64.76 -43.67 92.57 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 115.122 -0.945 . . . . 72.23 110.53 175.203 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.548 HG23 ' O ' ' A' ' 7' ' ' GLU . 74.7 t -62.81 -39.07 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 C-N-CA 124.499 1.12 . . . . 65.51 111.961 -176.27 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.585 ' HE2' ' HA ' ' A' ' 9' ' ' ARG . 49.7 mtmt -64.55 -36.16 83.31 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.291 0.637 . . . . 63.4 110.57 178.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.521 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.6 tt0 -67.09 -49.11 66.1 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 124.067 0.854 . . . . 70.45 109.889 175.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 10' ' ' GLN . 61.3 t -59.06 -32.42 47.81 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 123.387 0.675 . . . . 74.11 110.571 178.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.466 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -73.15 -49.36 28.68 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.254 1.021 . . . . 65.32 111.975 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -68.95 -36.64 78.15 Favored 'General case' 0 N--CA 1.479 1.008 0 O-C-N 123.753 0.658 . . . . 75.43 111.416 -173.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.521 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 16.0 mm-40 -64.65 -39.76 94.27 Favored 'General case' 0 C--N 1.353 0.719 0 O-C-N 123.711 0.632 . . . . 74.11 110.821 -177.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.405 ' HG3' HG21 ' A' ' 68' ' ' VAL . 14.8 mmmm -73.76 -29.92 62.49 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.122 0.569 . . . . 75.13 111.52 -178.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.523 HD23 ' NE2' ' A' ' 22' ' ' GLN . 64.7 mt -71.09 -32.17 68.73 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.041 0.537 . . . . 62.5 111.41 171.215 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.9 mt -71.02 -32.42 69.18 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.306 0.642 . . . . 72.33 110.222 173.091 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 21.8 mm-40 -61.86 -44.53 96.64 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.147 0.579 . . . . 71.24 110.306 176.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.523 ' NE2' HD23 ' A' ' 19' ' ' LEU . 48.0 mt-30 -71.01 -42.91 68.96 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.109 -0.95 . . . . 61.34 111.457 -179.147 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.9 t -138.82 91.74 11.62 Favored Pre-proline 0 C--O 1.241 0.632 0 CA-C-N 116.03 -0.532 . . . . 74.11 110.483 -177.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -72.33 -12.38 27.45 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 122.925 2.417 . . . . 73.33 111.539 165.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -69.98 -25.06 63.44 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 124.685 1.194 . . . . 73.02 111.236 177.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 7.4 m -116.95 146.25 43.11 Favored 'General case' 0 C--O 1.239 0.548 0 C-N-CA 123.705 0.802 . . . . 73.23 110.758 -176.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -94.65 120.94 35.67 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 107.648 -1.242 . . . . 50.32 107.648 172.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 47.6 t -97.56 135.42 32.01 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 C-N-CA 123.812 0.845 . . . . 74.35 109.481 -173.123 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 54.8 tp60 -130.99 133.69 46.02 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.449 0.7 . . . . 73.11 109.312 -178.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.576 HG11 ' HD2' ' A' ' 12' ' ' LYS . 53.5 t -59.95 118.84 3.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 123.101 0.561 . . . . 75.13 110.463 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.489 ' H ' ' HA ' ' A' ' 44' ' ' LEU . 26.3 tpt180 -90.4 -49.47 6.5 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.514 0.726 . . . . 73.21 109.701 -173.253 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 18.8 ttt180 -160.86 151.39 18.13 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.845 0.858 . . . . 61.14 109.774 -178.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.401 HG21 ' HD3' ' A' ' 12' ' ' LYS . 64.1 t -114.97 128.43 72.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 123.62 0.768 . . . . 75.02 109.214 173.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -117.22 137.6 52.26 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 124.677 1.191 . . . . 72.11 107.897 176.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -107.54 119.99 40.95 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 107.364 -1.347 . . . . 64.42 107.364 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -130.7 75.66 1.67 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.714 0.806 . . . . 71.33 108.882 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 63.02 -114.48 6.94 Favored Glycine 0 C--N 1.348 1.21 0 CA-C-N 114.932 -1.031 . . . . 40.2 112.724 -178.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -82.89 -21.16 34.32 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.111 0.565 . . . . 54.52 110.906 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.429 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 24.7 m -100.62 104.22 15.54 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.704 0.801 . . . . 73.22 110.67 -178.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.68 HD13 ' HG3' ' A' ' 8' ' ' LYS . 77.9 mt -83.77 109.12 16.91 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 N-CA-C 108.806 -0.812 . . . . 73.14 108.806 172.598 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.571 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 64.2 mtt180 -88.84 95.46 10.3 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.133 0.973 . . . . 70.5 110.045 -179.328 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 57.0 t -87.92 110.71 21.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 N-CA-C 109.08 -0.711 . . . . 72.23 109.08 176.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -76.43 134.1 39.68 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 109.429 -0.582 . . . . 73.24 109.429 169.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.489 ' HA ' ' H ' ' A' ' 31' ' ' ARG . 4.3 mp -131.78 168.4 17.87 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.058 0.543 . . . . 53.33 109.803 174.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -110.17 130.15 55.59 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 107.615 -1.254 . . . . 72.43 107.615 -179.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.627 ' HB3' ' CE2' ' A' ' 55' ' ' TYR . 6.8 tt -139.74 135.66 33.35 Favored 'General case' 0 C--O 1.249 1.057 0 N-CA-C 106.472 -1.677 . . . . 52.02 106.472 -179.516 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 83.1 mtt180 . . . . . 0 CA--C 1.536 0.412 0 CA-C-N 115.448 -0.796 . . . . 74.02 110.557 -166.965 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.238 0.48 0 N-CA-C 109.814 -0.439 . . . . 75.43 109.814 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 14.5 mp0 -129.6 139.31 51.5 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.346 0.658 . . . . 53.31 109.722 170.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -92.56 122.55 35.09 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.913 0.885 . . . . 64.13 109.181 172.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.627 ' CE2' ' HB3' ' A' ' 46' ' ' LEU . 12.0 m-85 -107.23 116.7 32.4 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 108.472 -0.936 . . . . 74.14 108.472 179.067 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 29.8 m -88.77 99.33 12.28 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 107.589 -1.263 . . . . 73.21 107.589 177.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.561 HG13 HG12 ' A' ' 71' ' ' ILE . 47.0 t -91.84 103.64 14.75 Favored 'Isoleucine or valine' 0 C--O 1.239 0.545 0 N-CA-C 107.339 -1.356 . . . . 73.12 107.339 -178.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.571 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 43.1 mt-10 -85.44 101.66 12.8 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.136 -1.393 . . . . 70.22 108.759 -174.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.491 ' HB ' HG13 ' A' ' 11' ' ' VAL . 34.5 t -112.09 112.75 41.86 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 C-N-CA 123.985 0.914 . . . . 63.41 108.944 -175.026 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.624 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 42.1 tt0 -105.04 149.39 25.84 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.586 0.755 . . . . 72.31 111.164 -174.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -77.11 112.02 13.31 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.687 0.795 . . . . 62.12 109.188 173.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -121.21 111.69 17.71 Favored 'General case' 0 C--O 1.242 0.694 0 N-CA-C 107.891 -1.152 . . . . 73.52 107.891 171.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 75.09 -109.35 2.76 Favored Glycine 0 C--N 1.346 1.121 0 N-CA-C 110.778 -0.929 . . . . 55.11 110.778 -174.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -123.13 5.61 9.22 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.328 0.651 . . . . 62.22 109.822 176.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 67.9 p -110.54 148.0 33.02 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.382 0.673 . . . . 74.44 110.912 -176.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -96.17 112.02 23.89 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.185 0.994 . . . . 74.33 108.826 173.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.0 t -113.79 131.31 56.27 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 123.666 0.786 . . . . 72.42 110.211 -173.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.407 HG22 HG22 ' A' ' 59' ' ' VAL . 98.4 t -70.28 107.71 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 N-CA-C 109.247 -0.649 . . . . 53.51 109.247 174.264 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.624 ' HD3' ' HB3' ' A' ' 60' ' ' GLU . 30.6 mmmt -66.82 -52.83 39.19 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 115.23 -0.895 . . . . 73.44 109.498 176.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.5 ptt180 -162.71 164.9 26.2 Favored 'General case' 0 C--O 1.241 0.636 0 CA-C-N 114.508 -1.224 . . . . 51.43 109.779 -179.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.561 HG12 HG13 ' A' ' 57' ' ' VAL . 41.5 mt -121.93 107.69 20.44 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 C-N-CA 123.947 0.899 . . . . 35.15 108.606 175.527 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 36.4 m -93.22 103.82 16.05 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.6 0.76 . . . . 63.34 109.836 -176.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 36.9 ttt180 -79.43 133.89 36.55 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.012 0.525 . . . . 62.41 109.63 175.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 8.1 t . . . . . 0 CA--C 1.544 0.735 0 N-CA-C 109.45 -0.574 . . . . 74.23 109.45 170.333 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 . . . . . 0 CA--C 1.54 0.576 0 N-CA-C 110.376 -0.231 . . . . 73.13 110.376 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.539 ' O ' HG23 ' A' ' 11' ' ' VAL . 33.5 mm-40 -63.15 -49.76 73.05 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-O 118.988 -0.53 . . . . 74.11 110.02 177.333 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.46 -25.82 68.19 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 112.153 0.427 . . . . 75.12 112.153 178.646 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -63.65 -45.46 90.09 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.067 0.46 . . . . 75.34 109.832 172.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.401 ' O ' HG23 ' A' ' 14' ' ' VAL . 46.5 mt-30 -69.04 -37.73 78.74 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 115.229 -0.896 . . . . 72.23 110.843 177.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 7' ' ' GLU . 79.7 t -66.23 -50.68 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 123.806 0.842 . . . . 63.24 111.769 -174.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.512 ' HD3' HG21 ' A' ' 33' ' ' VAL . 34.3 mtmm -65.84 -32.86 74.62 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 123.236 0.335 . . . . 71.43 111.036 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -65.89 -53.52 38.51 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 123.728 0.642 . . . . 45.15 110.285 177.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.472 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 78.9 t -59.2 -37.72 70.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 C-N-CA 123.03 0.532 . . . . 75.43 110.351 178.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.36 -44.77 86.59 Favored 'General case' 0 C--O 1.246 0.901 0 C-N-CA 123.613 0.765 . . . . 73.51 111.899 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -71.38 -31.24 67.08 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 116.396 -0.365 . . . . 72.23 110.591 -178.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.493 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 47.1 mt-10 -65.79 -39.86 91.36 Favored 'General case' 0 C--N 1.355 0.816 0 O-C-N 123.899 0.749 . . . . 61.44 110.686 179.766 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.5 ' HB2' HD11 ' A' ' 71' ' ' ILE . 67.8 mmtt -73.21 -28.2 62.04 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-O 120.81 0.338 . . . . 72.23 110.69 178.718 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.571 ' HB3' HD12 ' A' ' 46' ' ' LEU . 53.3 mt -70.2 -31.09 68.37 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.971 0.509 . . . . 73.34 111.069 169.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.1 mt -79.68 -17.95 52.49 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.891 0.876 . . . . 65.13 110.946 175.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 8.7 mm-40 -71.63 -41.05 69.29 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 109.736 -0.468 . . . . 74.0 109.736 172.278 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.425 ' NE2' HD23 ' A' ' 19' ' ' LEU . 42.0 mt-30 -76.54 -37.25 56.94 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 115.276 -0.875 . . . . 64.41 110.554 178.293 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.3 t -153.69 86.42 3.9 Favored Pre-proline 0 CA--C 1.551 1.006 0 C-N-CA 123.693 0.797 . . . . 43.12 110.779 -173.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo -78.37 -19.22 11.91 Favored 'Trans proline' 0 C--N 1.374 1.92 0 C-N-CA 122.505 2.137 . . . . 40.02 112.629 177.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.467 HD22 ' N ' ' A' ' 25' ' ' ASN . 0.7 OUTLIER -77.44 -19.68 55.67 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.68 0.792 . . . . 73.31 111.05 -175.24 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 31.4 m -100.13 141.58 32.76 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.178 0.591 . . . . 73.12 110.047 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -77.4 119.85 21.58 Favored 'General case' 0 C--O 1.243 0.755 0 C-N-CA 124.03 0.932 . . . . 72.41 109.546 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.9 t -98.32 112.4 30.33 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 N-CA-C 109.429 -0.582 . . . . 55.34 109.429 -178.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.435 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 30.7 mm-40 -94.93 174.42 7.1 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.353 1.061 . . . . 64.33 109.367 172.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.457 HG11 ' HD2' ' A' ' 12' ' ' LYS . 47.1 t -106.38 137.21 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 N-CA-C 108.961 -0.755 . . . . 61.45 108.961 169.352 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -102.7 -54.2 2.7 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.936 0.495 . . . . 74.11 110.19 179.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -153.88 147.84 25.55 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.994 0.918 . . . . 72.22 109.103 -176.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.531 HG13 HG22 ' A' ' 42' ' ' VAL . 88.1 t -121.51 118.83 57.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 N-CA-C 108.347 -0.983 . . . . 64.15 108.347 176.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -116.66 109.87 17.75 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.146 0.578 . . . . 63.34 109.743 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.52 ' HG2' HG12 ' A' ' 40' ' ' ILE . 2.8 tmtp? -83.65 117.25 23.06 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 107.138 -1.43 . . . . 75.12 107.138 178.664 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.0 89.88 2.81 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 108.983 -0.747 . . . . 71.41 108.983 -178.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.407 ' O ' ' HE2' ' A' ' 35' ' ' LYS . . . 69.08 -111.46 3.94 Favored Glycine 0 C--N 1.344 1.023 0 O-C-N 123.612 0.57 . . . . 74.12 113.464 173.41 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -96.92 1.14 50.09 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.29 0.636 . . . . 73.42 111.388 177.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 23.7 m -131.24 107.88 9.3 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.327 0.651 . . . . 71.3 110.211 -176.143 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.535 HD12 HG21 ' A' ' 11' ' ' VAL . 33.7 mt -83.62 107.46 15.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 N-CA-C 108.497 -0.927 . . . . 71.45 108.497 172.089 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.527 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 98.1 mtt180 -86.36 95.27 9.6 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 109.008 -0.738 . . . . 75.11 109.008 176.097 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.531 HG22 HG13 ' A' ' 33' ' ' VAL . 58.5 t -86.73 113.48 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 N-CA-C 108.762 -0.829 . . . . 64.43 108.762 177.194 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -86.98 104.42 16.28 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 124.087 0.955 . . . . 64.31 108.518 174.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.435 ' HB3' ' O ' ' A' ' 29' ' ' GLN . 4.8 mp -97.24 165.93 11.81 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 109.754 -0.461 . . . . 52.5 109.754 179.393 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -116.64 104.85 11.8 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.119 0.485 . . . . 72.42 109.983 -179.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.571 HD12 ' HB3' ' A' ' 19' ' ' LEU . 6.8 tt -107.42 129.39 54.94 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 106.927 -1.508 . . . . 73.4 106.927 177.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 55.8 mtm180 . . . . . 0 N--CA 1.471 0.614 0 N-CA-C 108.48 -0.933 . . . . 61.41 108.48 -178.302 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt . . . . . 0 CA--C 1.536 0.44 0 N-CA-C 108.562 -0.903 . . . . 72.3 108.562 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -126.26 145.38 50.43 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.17 0.588 . . . . 75.13 110.17 -177.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -108.32 129.98 55.21 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.207 0.603 . . . . 52.54 109.421 177.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.467 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 42.0 m-85 -113.91 118.93 35.58 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 108.911 -0.774 . . . . 73.14 108.911 179.085 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 31.9 m -83.57 101.45 11.47 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 108.948 -0.76 . . . . 34.34 108.948 176.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.464 HG13 HG12 ' A' ' 71' ' ' ILE . 48.0 t -94.91 110.38 23.81 Favored 'Isoleucine or valine' 0 C--O 1.239 0.514 0 CA-C-N 115.24 -0.891 . . . . 72.5 109.274 179.362 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.527 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 37.3 mt-10 -78.66 106.35 10.58 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.961 0.904 . . . . 70.1 109.089 177.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.549 HG22 HG22 ' A' ' 68' ' ' VAL . 41.6 t -111.65 114.36 46.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 N-CA-C 108.657 -0.868 . . . . 73.42 108.657 178.009 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -102.26 155.88 17.93 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.279 1.032 . . . . 64.0 110.781 -171.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.448 ' NH2' ' HA ' ' A' ' 64' ' ' ASN . 14.6 tpt180 -89.35 133.09 34.65 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.637 0.775 . . . . 75.15 110.146 -177.216 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -141.22 91.85 2.43 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 108.729 -0.841 . . . . 74.41 108.729 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.94 -102.78 1.03 Allowed Glycine 0 C--N 1.345 1.031 0 CA-C-N 116.095 -0.502 . . . . 44.52 112.707 179.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.448 ' HA ' ' NH2' ' A' ' 61' ' ' ARG . 19.8 m-80 -115.15 1.94 13.99 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.158 0.983 . . . . 73.14 111.174 177.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 71.5 p -115.51 166.63 11.68 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.812 0.845 . . . . 72.44 110.769 -178.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -117.65 136.37 53.37 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.116 0.966 . . . . 73.45 108.77 174.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 6.2 t -126.01 122.38 35.72 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.004 0.921 . . . . 64.44 110.048 -175.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.549 HG22 HG22 ' A' ' 59' ' ' VAL . 86.2 t -73.59 115.83 15.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 122.593 0.357 . . . . 72.12 110.203 178.23 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -74.57 -57.07 4.16 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.028 0.931 . . . . 73.44 110.441 178.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -160.47 148.2 16.2 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 116.174 -0.466 . . . . 72.32 110.683 -178.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.5 HD11 ' HB2' ' A' ' 18' ' ' LYS . 47.0 mt -105.44 106.78 21.16 Favored 'Isoleucine or valine' 0 C--O 1.24 0.596 0 N-CA-C 108.608 -0.886 . . . . 63.51 108.608 168.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 66.7 m -109.57 115.59 30.18 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.683 0.793 . . . . 72.24 108.92 176.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.467 ' HA ' ' HA ' ' A' ' 55' ' ' TYR . 49.4 ttp180 -68.38 145.66 53.94 Favored 'General case' 0 C--O 1.243 0.722 0 N-CA-C 109.473 -0.566 . . . . 63.15 109.473 176.283 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 14.6 t . . . . . 0 C--O 1.242 0.69 0 O-C-N 123.863 0.727 . . . . 72.11 110.081 -179.464 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.5 mm-40 . . . . . 0 N--CA 1.478 0.969 0 N-CA-C 112.744 0.646 . . . . 74.02 112.744 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.575 ' O ' HG23 ' A' ' 11' ' ' VAL . 77.2 mt-10 -57.14 -56.89 15.95 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 124.085 0.866 . . . . 74.54 109.407 170.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -69.21 -32.21 71.32 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.257 0.623 . . . . 73.33 110.71 -176.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 29.8 mmt180 -55.45 -48.98 73.63 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.564 0.746 . . . . 62.2 110.122 174.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.547 ' O ' HG23 ' A' ' 14' ' ' VAL . 64.7 mt-30 -64.32 -45.38 88.15 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 114.26 -1.336 . . . . 70.31 111.16 178.172 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.619 HG21 HD12 ' A' ' 40' ' ' ILE . 59.0 t -61.53 -44.51 98.72 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 123.23 0.612 . . . . 73.33 111.899 -176.044 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt -65.19 -34.25 77.94 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.092 0.557 . . . . 71.01 110.24 178.27 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.48 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 8.5 tt0 -64.59 -51.7 61.33 Favored 'General case' 0 C--N 1.352 0.704 0 CA-C-N 115.656 -0.702 . . . . 72.5 110.418 175.192 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.547 HG23 ' O ' ' A' ' 10' ' ' GLN . 45.0 t -56.5 -46.75 82.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 C-N-CA 123.129 0.572 . . . . 74.12 109.578 -179.307 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.454 ' HB1' HD11 ' A' ' 44' ' ' LEU . . . -60.23 -47.5 85.72 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 114.896 -1.047 . . . . 62.41 112.29 -179.305 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -71.1 -35.4 71.8 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 122.822 0.449 . . . . 74.45 111.321 -175.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 36.4 mm-40 -69.09 -34.6 75.35 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.933 0.493 . . . . 75.51 111.021 -179.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.606 ' HB3' HD11 ' A' ' 71' ' ' ILE . 75.2 mmtt -68.16 -35.43 78.06 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.955 0.502 . . . . 70.31 111.063 176.102 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.551 ' HB3' HD12 ' A' ' 46' ' ' LEU . 29.8 mt -68.05 -31.84 71.78 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 115.518 -0.764 . . . . 74.33 111.291 174.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 84.9 mt -73.75 -26.11 60.5 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.927 0.891 . . . . 73.4 111.268 174.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 62.9 mm-40 -66.94 -40.68 87.63 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.652 0.381 . . . . 73.1 110.288 173.309 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -72.89 -40.92 65.19 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 123.892 0.745 . . . . 74.13 111.087 178.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.2 t -142.68 99.79 5.64 Favored Pre-proline 0 CA--C 1.548 0.867 0 CA-C-N 115.358 -0.837 . . . . 63.45 109.349 -175.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -79.61 -3.5 12.95 Favored 'Trans proline' 0 C--N 1.38 2.219 0 C-N-CA 122.598 2.198 . . . . 74.43 111.995 171.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -101.07 21.63 13.55 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.015 1.326 . . . . 74.55 110.269 -179.29 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 92.9 p -125.89 153.46 44.16 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 112.321 0.489 . . . . 51.42 112.321 -175.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -96.76 121.98 39.21 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 108.327 -0.99 . . . . 54.11 108.327 164.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 38.7 t -100.95 113.21 36.27 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 122.919 0.488 . . . . 73.12 109.739 177.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -96.74 159.4 14.95 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.225 1.01 . . . . 71.31 108.752 170.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.6 p -98.85 118.3 45.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 N-CA-C 108.413 -0.958 . . . . 72.04 108.413 170.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 21.8 tpt180 -85.78 -57.65 2.96 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 123.035 0.534 . . . . 72.12 110.429 -174.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.0 tpt180 -156.61 144.14 19.14 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.511 0.724 . . . . 75.31 109.753 -172.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 86.0 t -127.95 122.75 59.23 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 123.139 0.576 . . . . 72.32 110.282 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -106.8 129.53 54.65 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.641 1.176 . . . . 74.52 108.863 169.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.473 ' HG2' HG12 ' A' ' 40' ' ' ILE . 13.1 tmtt? -104.88 108.08 19.38 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 106.989 -1.486 . . . . 75.24 106.989 173.191 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -122.66 93.29 3.92 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.273 0.629 . . . . 73.41 110.173 -177.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 70.08 -98.13 0.62 Allowed Glycine 0 C--N 1.35 1.346 0 CA-C-N 115.497 -0.774 . . . . 73.22 112.343 178.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 47.5 m-80 -111.08 -29.25 7.96 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.052 0.541 . . . . 72.32 110.21 173.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 19.0 m -83.97 101.47 11.74 Favored 'General case' 0 C--N 1.352 0.69 0 CA-C-O 121.112 0.482 . . . . 63.33 110.204 -178.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.619 HD12 HG21 ' A' ' 11' ' ' VAL . 31.1 mt -87.95 112.69 23.95 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 CA-C-N 115.838 -0.619 . . . . 64.52 109.533 172.538 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.498 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 90.2 mtt180 -81.84 97.77 8.18 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 123.725 0.81 . . . . 73.14 109.645 174.346 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.431 HG12 ' HG ' ' A' ' 44' ' ' LEU . 61.2 t -91.3 107.42 18.69 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 N-CA-C 107.88 -1.156 . . . . 65.54 107.88 172.137 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -82.85 122.16 27.87 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 114.984 -1.007 . . . . 74.44 108.392 168.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.454 HD11 ' HB1' ' A' ' 15' ' ' ALA . 2.5 mp -116.41 153.64 31.7 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 109.358 -0.608 . . . . 74.15 109.358 -179.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.439 ' HG3' ' HD3' ' A' ' 52' ' ' LYS . 31.2 tt0 -111.42 103.89 12.29 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 109.301 -0.629 . . . . 74.12 109.301 175.594 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.551 HD12 ' HB3' ' A' ' 19' ' ' LEU . 7.3 tt -102.38 154.0 19.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.419 1.088 . . . . 74.34 109.444 -174.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 62.9 mtp180 . . . . . 0 N--CA 1.48 1.038 0 C-N-CA 123.439 0.696 . . . . 73.44 110.64 177.493 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.439 ' HD3' ' HG3' ' A' ' 45' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.415 0 N-CA-C 108.814 -0.81 . . . . 74.24 108.814 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -128.1 111.94 14.04 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.565 1.146 . . . . 64.4 109.061 178.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -78.78 133.68 37.07 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 109.067 -0.716 . . . . 75.52 109.067 173.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.421 ' HE2' HD22 ' A' ' 46' ' ' LEU . 75.9 m-85 -114.41 171.72 7.45 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.431 0.692 . . . . 75.13 109.887 172.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 86.2 m -143.88 102.64 3.93 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 106.7 -1.593 . . . . 73.31 106.7 175.236 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.441 HG22 HG12 ' A' ' 71' ' ' ILE . 46.9 t -98.84 105.06 16.8 Favored 'Isoleucine or valine' 0 C--O 1.243 0.723 0 N-CA-C 107.608 -1.256 . . . . 74.32 107.608 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.498 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 28.1 mt-10 -80.52 102.3 9.65 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 115.442 -0.799 . . . . 74.2 109.433 178.562 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.554 HG22 HG22 ' A' ' 68' ' ' VAL . 25.9 t -105.71 115.67 47.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 C-N-CA 124.109 0.963 . . . . 72.41 108.711 -178.697 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.598 ' HB3' ' HE2' ' A' ' 69' ' ' LYS . 35.6 tt0 -102.25 154.76 18.73 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.72 0.808 . . . . 64.51 110.023 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 29.5 ttp180 -80.29 139.64 36.55 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 120.958 0.408 . . . . 64.02 111.733 177.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -127.09 103.18 7.3 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.89 1.276 . . . . 75.41 107.642 172.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.31 -110.76 3.52 Favored Glycine 0 CA--C 1.53 1.007 0 N-CA-C 111.533 -0.627 . . . . 71.14 111.533 -173.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -101.34 -21.62 14.8 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.01 0.524 . . . . 71.14 110.869 170.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.8 p -86.22 174.73 8.91 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.193 0.597 . . . . 62.24 110.53 -172.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 89.3 m95 -124.98 147.38 48.95 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.625 0.77 . . . . 71.11 108.936 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.2 t -145.91 135.35 23.07 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.078 0.551 . . . . 73.3 110.224 -170.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.595 HG21 ' HG3' ' A' ' 18' ' ' LYS . 70.5 t -85.08 129.76 37.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 123.62 0.768 . . . . 75.13 110.593 -176.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.598 ' HE2' ' HB3' ' A' ' 60' ' ' GLU . 74.8 mmtt -81.5 -50.39 9.46 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.916 -0.583 . . . . 62.0 109.871 175.229 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 26.9 ptt-85 -168.83 167.63 10.92 Favored 'General case' 0 C--O 1.245 0.84 0 CA-C-N 115.35 -0.841 . . . . 64.5 110.111 -177.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.606 HD11 ' HB3' ' A' ' 18' ' ' LYS . 59.5 mt -117.81 109.09 26.26 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 115.089 -0.96 . . . . 74.33 108.851 173.568 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 34.2 m -102.56 124.3 47.86 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 109.677 -0.49 . . . . 44.15 109.677 178.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 46.7 ttp180 -82.82 146.85 28.7 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 108.718 -0.845 . . . . 74.32 108.718 171.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.3 t . . . . . 0 C--O 1.247 0.929 0 C-N-CA 123.034 0.534 . . . . 54.52 110.368 172.976 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.415 ' O ' ' HG2' ' A' ' 10' ' ' GLN . 2.6 mp0 . . . . . 0 C--O 1.242 0.685 0 N-CA-C 111.528 0.196 . . . . 74.41 111.528 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.523 ' O ' HG23 ' A' ' 11' ' ' VAL . 51.0 mt-10 -56.43 -55.38 34.28 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 109.018 -0.734 . . . . 75.22 109.018 171.076 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.474 ' HG3' HG11 ' A' ' 33' ' ' VAL . 0.6 OUTLIER -55.91 -40.96 73.83 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 124.918 1.386 . . . . 74.32 110.368 -175.27 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 84.1 mtt-85 -55.25 -46.0 76.05 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.233 1.013 . . . . 75.03 110.66 177.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.442 ' O ' HG23 ' A' ' 14' ' ' VAL . 68.3 mm-40 -72.29 -50.89 23.61 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.423 -0.808 . . . . 62.23 110.739 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 7' ' ' GLU . 43.0 t -64.32 -35.98 75.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 124.156 0.982 . . . . 65.44 112.026 -167.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 47.2 mtmt -63.1 -41.83 99.45 Favored 'General case' 0 N--CA 1.484 1.237 0 O-C-N 123.277 0.361 . . . . 42.54 110.09 176.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.456 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 9.5 tt0 -67.3 -43.94 80.46 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 124.249 0.968 . . . . 72.11 110.315 178.554 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.489 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 98.9 t -60.58 -43.43 94.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.369 0.668 . . . . 75.14 109.682 178.297 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.06 -41.61 73.92 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 114.782 -1.099 . . . . 41.1 112.078 -174.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.403 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 21.0 ptmt -67.13 -36.86 82.78 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 123.484 0.49 . . . . 73.02 110.114 -177.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.464 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 50.8 mt-10 -58.48 -46.01 87.52 Favored 'General case' 0 C--N 1.366 1.285 0 O-C-N 124.306 1.004 . . . . 74.42 109.788 177.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.489 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 31.9 mmmt -56.3 -43.76 79.24 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 124.671 1.232 . . . . 75.43 111.014 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 43.6 mt -72.08 -29.74 64.41 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 114.948 -1.023 . . . . 72.52 111.5 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 97.7 mt -76.03 -25.23 55.45 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.293 0.637 . . . . 73.24 111.108 176.526 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 17.4 mm-40 -67.42 -35.02 78.44 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-O 121.453 0.644 . . . . 74.31 109.911 175.276 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.484 HE22 HG21 ' A' ' 71' ' ' ILE . 48.0 mt-30 -88.77 -28.6 20.38 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 114.931 -1.031 . . . . 74.24 111.336 -179.152 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.514 ' HB3' HD11 ' A' ' 46' ' ' LEU . 32.4 t -150.93 84.92 5.26 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 123.248 0.619 . . . . 73.51 110.332 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -79.73 -6.41 14.33 Favored 'Trans proline' 0 C--N 1.376 2.019 0 C-N-CA 122.78 2.32 . . . . 75.43 112.946 176.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -90.11 7.49 37.62 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.655 0.782 . . . . 72.11 111.754 -178.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 39.9 t -133.25 158.52 42.7 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.375 0.67 . . . . 74.25 109.787 176.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -99.81 131.64 45.67 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.734 0.813 . . . . 63.05 108.948 177.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 40.9 t -98.46 129.92 48.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 C-N-CA 123.669 0.787 . . . . 73.11 109.679 -178.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -108.95 163.43 13.3 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.842 1.257 . . . . 71.45 109.526 177.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.8 p -90.99 119.06 37.45 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 N-CA-C 108.936 -0.765 . . . . 74.45 108.936 172.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 32.1 tpt180 -91.08 -58.37 2.49 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 109.195 -0.669 . . . . 55.54 109.195 178.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 -150.84 163.87 37.61 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.695 1.198 . . . . 65.22 109.578 173.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.53 HG13 HG22 ' A' ' 42' ' ' VAL . 47.0 t -131.96 115.85 28.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 N-CA-C 108.235 -1.024 . . . . 63.12 108.235 172.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 24.3 mp0 -101.23 124.98 47.77 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.363 0.665 . . . . 61.41 110.309 177.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.4 tptt -95.79 111.49 23.44 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.543 1.137 . . . . 73.2 109.341 175.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.512 HE22 ' H ' ' A' ' 41' ' ' ARG . 0.0 OUTLIER -121.26 72.2 0.98 Allowed 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 108.892 -0.781 . . . . 75.53 108.892 175.941 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 59.33 -104.35 0.53 Allowed Glycine 0 C--N 1.344 0.996 0 CA-C-N 115.353 -0.84 . . . . 55.21 113.121 179.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -75.55 -41.56 54.62 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.082 0.553 . . . . 75.25 110.503 -179.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.466 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 29.0 m -95.57 117.94 31.36 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.214 0.605 . . . . 61.54 111.144 -175.217 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 38.2 mt -98.04 116.8 41.64 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 123.558 0.743 . . . . 54.41 109.235 169.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.512 ' H ' HE22 ' A' ' 36' ' ' GLN . 61.5 mtt180 -103.37 99.66 9.5 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 108.594 -0.891 . . . . 62.33 108.594 178.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.53 HG22 HG13 ' A' ' 33' ' ' VAL . 39.5 t -85.52 125.87 40.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 109.098 -0.704 . . . . 70.14 109.098 179.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -85.93 122.03 29.4 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 107.953 -1.129 . . . . 72.31 107.953 166.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.433 ' O ' ' HA ' ' A' ' 54' ' ' ASN . 4.2 mp -117.53 169.06 9.84 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.073 0.549 . . . . 53.34 109.643 178.052 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -134.19 103.0 5.58 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.224 0.535 . . . . 64.23 109.612 -174.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.514 HD11 ' HB3' ' A' ' 23' ' ' SER . 8.7 tt -110.36 134.79 51.95 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 106.831 -1.544 . . . . 64.5 106.831 178.308 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 74.7 mtt85 . . . . . 0 N--CA 1.471 0.587 0 CA-C-O 121.463 0.649 . . . . 51.51 110.1 -175.595 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 79.4 tttt . . . . . 0 CA--C 1.543 0.698 0 N-CA-C 109.664 -0.495 . . . . 61.21 109.664 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -105.66 112.87 26.11 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.887 0.875 . . . . 73.35 109.457 175.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.433 ' HA ' ' O ' ' A' ' 44' ' ' LEU . 17.0 m120 -91.65 118.4 30.61 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.128 0.571 . . . . 72.13 110.239 176.68 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -108.14 120.69 43.07 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 109.043 -0.725 . . . . 71.52 109.043 177.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 57.0 m -88.31 102.41 14.82 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.841 -0.8 . . . . 74.5 108.841 173.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.403 HG13 HD13 ' A' ' 71' ' ' ILE . 96.7 t -93.22 106.09 17.56 Favored 'Isoleucine or valine' 0 C--O 1.24 0.564 0 N-CA-C 108.371 -0.974 . . . . 72.24 108.371 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -86.17 104.28 15.59 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 114.491 -1.232 . . . . 73.21 108.811 -176.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 17.5 t -113.84 128.88 70.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 124.138 0.975 . . . . 65.55 108.7 -178.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.466 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 38.2 tt0 -112.33 150.02 31.61 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.089 0.555 . . . . 62.41 110.476 -176.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.4 tpp85 -73.08 128.34 35.19 Favored 'General case' 0 C--N 1.35 0.59 0 C-N-CA 123.912 0.885 . . . . 72.24 110.649 -177.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -122.95 90.44 3.29 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 107.911 -1.144 . . . . 63.11 107.911 172.029 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 72.2 -103.32 1.29 Allowed Glycine 0 C--N 1.348 1.225 0 CA-C-N 116.127 -0.488 . . . . 54.25 112.603 -177.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -119.83 2.9 11.1 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 124.125 0.97 . . . . 74.43 110.247 173.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 18.7 p -113.5 176.59 4.96 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.519 0.728 . . . . 64.43 109.705 176.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -118.72 153.36 34.52 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.051 0.941 . . . . 74.01 111.323 -174.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 4.9 t -137.33 117.41 13.41 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.217 1.007 . . . . 64.35 108.741 175.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.7 t -69.41 108.46 1.88 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.508 0 N-CA-C 109.254 -0.647 . . . . 74.45 109.254 176.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -67.49 -57.53 6.36 Favored 'General case' 0 C--O 1.237 0.432 0 O-C-N 123.983 0.802 . . . . 63.14 110.27 177.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -151.36 141.03 21.76 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.117 -0.492 . . . . 74.2 111.329 -172.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.484 HG21 HE22 ' A' ' 22' ' ' GLN . 34.1 mm -93.46 105.43 16.82 Favored 'Isoleucine or valine' 0 C--N 1.352 0.692 0 N-CA-C 107.884 -1.154 . . . . 75.3 107.884 165.079 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 74.4 m -96.49 131.17 43.36 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 108.724 -0.843 . . . . 75.11 108.724 173.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -98.31 148.51 23.58 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 108.731 -0.84 . . . . 73.25 108.731 172.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.4 t . . . . . 0 CA--C 1.551 1.017 0 N-CA-C 109.153 -0.684 . . . . 51.45 109.153 170.12 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.47 ' HA ' ' HD3' ' A' ' 9' ' ' ARG . 37.1 tt0 . . . . . 0 N--CA 1.479 1.002 0 N-CA-C 111.759 0.281 . . . . 73.3 111.759 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.608 ' HG3' ' HD2' ' A' ' 8' ' ' LYS . 9.7 pt-20 -60.27 -33.95 73.04 Favored 'General case' 0 C--O 1.211 -0.958 0 CA-C-O 119.451 -0.309 . . . . 71.22 110.48 178.512 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.608 ' HD2' ' HG3' ' A' ' 7' ' ' GLU . 12.3 mptt -64.45 -43.86 92.96 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.16 0.584 . . . . 63.22 110.067 175.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.485 ' HA ' ' HE2' ' A' ' 12' ' ' LYS . 72.2 mtp180 -57.92 -43.26 86.12 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.117 0.967 . . . . 73.4 110.392 177.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.446 ' O ' HG23 ' A' ' 14' ' ' VAL . 50.8 mt-30 -64.71 -46.41 82.45 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 114.537 -1.211 . . . . 62.41 110.839 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.598 HG21 HD12 ' A' ' 40' ' ' ILE . 41.4 t -63.07 -39.7 86.21 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 124.793 1.237 . . . . 72.14 111.927 -177.148 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.485 ' HE2' ' HA ' ' A' ' 9' ' ' ARG . 49.8 mtmt -64.06 -37.5 87.67 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.54 0.736 . . . . 53.41 110.397 178.491 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -71.41 -43.67 66.35 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-N 115.552 -0.749 . . . . 75.34 110.554 179.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 10' ' ' GLN . 87.7 t -58.94 -42.3 85.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 124.036 0.934 . . . . 51.21 110.299 176.41 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.34 -48.93 68.66 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 114.825 -1.079 . . . . 42.21 111.777 -177.653 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.424 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 19.8 ptmt -67.09 -28.55 68.27 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 115.755 -0.657 . . . . 55.22 111.051 -175.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -60.56 -43.83 96.84 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.429 0.691 . . . . 75.32 111.478 176.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.502 ' HG3' HG21 ' A' ' 68' ' ' VAL . 59.3 mmtt -70.54 -26.7 63.69 Favored 'General case' 0 N--CA 1.481 1.108 0 O-C-N 123.708 0.63 . . . . 64.31 110.147 -178.579 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.705 ' HB3' HD12 ' A' ' 46' ' ' LEU . 21.8 mt -75.23 -32.06 61.04 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 115.107 -0.951 . . . . 64.51 111.22 173.481 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 95.4 mt -73.35 -21.79 60.45 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.425 0.69 . . . . 75.2 111.287 175.638 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -66.67 -36.18 81.92 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-O 121.544 0.687 . . . . 73.44 110.09 173.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.462 HE21 ' HA ' ' A' ' 19' ' ' LEU . 45.8 mt-30 -81.29 -41.51 22.02 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 114.82 -1.082 . . . . 72.41 111.069 -179.723 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.4 t -153.96 89.45 3.41 Favored Pre-proline 0 CA--C 1.554 1.114 0 C-N-CA 123.524 0.73 . . . . 73.32 109.364 -174.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.33 -26.73 10.13 Favored 'Trans proline' 0 C--N 1.375 1.943 0 C-N-CA 122.809 2.339 . . . . 73.53 113.067 177.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -68.9 -25.98 64.87 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.633 0.773 . . . . 70.52 111.298 -174.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 35.0 p -84.11 138.36 33.07 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.781 0.832 . . . . 63.5 110.845 177.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.507 ' HB3' ' NH2' ' A' ' 47' ' ' ARG . 2.7 tpmt? -82.31 111.78 18.69 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 108.432 -0.951 . . . . 64.41 108.432 175.165 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 41.0 t -97.45 120.05 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 124.062 0.945 . . . . 71.24 109.512 -173.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.431 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 84.5 mm-40 -107.27 172.18 6.97 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.261 1.024 . . . . 54.33 109.219 174.173 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.484 HG21 ' HB3' ' A' ' 12' ' ' LYS . 57.6 t -102.55 123.05 55.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 108.627 -0.879 . . . . 73.34 108.627 176.056 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.5 tpt180 -92.13 -48.13 6.88 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.152 0.581 . . . . 65.04 110.684 -174.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -149.26 145.04 26.88 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.572 1.149 . . . . 73.13 107.932 -173.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.441 HG22 HG13 ' A' ' 42' ' ' VAL . 86.3 t -125.17 130.6 73.03 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 N-CA-C 108.519 -0.919 . . . . 72.43 108.519 173.161 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -120.43 108.28 13.92 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.15 0.98 . . . . 63.33 109.415 178.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.6 tmtt? -97.16 111.97 23.97 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 108.312 -0.995 . . . . 74.13 108.312 -177.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -126.0 86.69 2.56 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.46 0.704 . . . . 72.33 109.48 -176.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 60.56 -80.77 0.01 OUTLIER Glycine 0 C--N 1.353 1.489 0 N-CA-C 115.223 0.849 . . . . 42.2 115.223 172.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -103.68 -45.81 4.7 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.181 0.993 . . . . 72.13 110.359 -177.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.543 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 8.9 m -100.33 133.69 44.37 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.231 0.613 . . . . 62.2 111.134 -175.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.598 HD12 HG21 ' A' ' 11' ' ' VAL . 32.7 mt -110.5 109.01 26.88 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.9 0 C-N-CA 123.481 0.712 . . . . 72.23 109.395 174.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 39.3 mtm180 -86.19 96.77 10.03 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 109.24 -0.652 . . . . 71.14 109.24 176.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.47 HG21 HG12 ' A' ' 11' ' ' VAL . 60.7 t -90.82 117.01 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 123.143 0.577 . . . . 73.24 109.47 176.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -91.73 115.28 27.92 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.462 1.105 . . . . 43.13 108.83 174.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.431 ' HB3' ' O ' ' A' ' 29' ' ' GLN . 4.1 mp -111.1 159.48 17.78 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 122.025 -0.422 . . . . 55.33 110.375 -176.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -106.48 107.19 18.07 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 109.184 -0.673 . . . . 72.32 109.184 178.225 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.705 HD12 ' HB3' ' A' ' 19' ' ' LEU . 7.1 tt -111.19 125.47 53.83 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 106.918 -1.512 . . . . 73.01 106.918 175.547 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.507 ' NH2' ' HB3' ' A' ' 27' ' ' LYS . 43.4 mtm180 . . . . . 0 N--CA 1.473 0.685 0 N-CA-C 109.282 -0.636 . . . . 61.41 109.282 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 76.4 tttt . . . . . 0 N--CA 1.48 1.047 0 CA-C-O 120.821 0.343 . . . . 73.14 110.448 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -134.53 122.31 22.23 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.911 1.284 . . . . 64.35 108.276 175.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -88.03 140.2 29.74 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 109.787 -0.449 . . . . 70.44 109.787 176.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -120.46 121.58 38.8 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.333 0.653 . . . . 73.32 109.562 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 24.6 m -86.97 103.72 15.61 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 108.17 -1.048 . . . . 73.1 108.17 175.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.448 HG13 HD13 ' A' ' 71' ' ' ILE . 58.7 t -102.3 114.81 42.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 124.218 1.007 . . . . 63.32 109.096 -179.181 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -89.02 101.98 14.63 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 109.063 -0.717 . . . . 73.0 109.063 179.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.59 ' HB ' HG13 ' A' ' 11' ' ' VAL . 22.2 t -105.11 109.99 29.48 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 C-N-CA 123.551 0.74 . . . . 64.33 109.273 178.055 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.543 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 34.8 tt0 -102.07 144.62 30.43 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.765 1.226 . . . . 73.24 111.039 -172.043 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 7.5 tpp180 -69.73 105.81 2.87 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.643 0.777 . . . . 71.4 109.574 176.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 52.2 tp60 -97.17 86.42 3.94 Favored 'General case' 0 C--O 1.242 0.707 0 N-CA-C 108.58 -0.896 . . . . 72.3 108.58 176.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 68.71 -101.02 0.73 Allowed Glycine 0 C--N 1.348 1.2 0 CA-C-N 115.18 -0.918 . . . . 54.13 111.168 -175.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -100.37 -33.05 10.54 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.67 1.188 . . . . 60.42 110.25 176.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 24.8 p -86.32 177.38 7.49 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.878 0.871 . . . . 64.52 110.814 -178.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -111.78 158.94 18.77 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.059 0.944 . . . . 73.41 109.038 172.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.5 t -145.99 137.65 24.98 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.675 0.79 . . . . 73.42 109.13 179.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.502 HG21 ' HG3' ' A' ' 18' ' ' LYS . 96.7 t -86.03 115.12 26.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 N-CA-C 108.94 -0.763 . . . . 64.31 108.94 176.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -74.89 -49.74 19.32 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 124.297 1.039 . . . . 61.33 110.25 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.1 ptp85 -157.89 159.92 37.1 Favored 'General case' 0 C--O 1.244 0.792 0 CA-C-N 115.228 -0.896 . . . . 73.03 111.277 177.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.448 HD13 HG13 ' A' ' 57' ' ' VAL . 36.4 mm -114.41 122.98 69.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 N-CA-C 106.508 -1.664 . . . . 73.33 106.508 167.281 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 11.7 t -126.98 133.93 50.48 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 109.116 -0.698 . . . . 75.2 109.116 171.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 22.1 ttm180 -91.92 140.33 29.78 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.382 -0.97 . . . . 74.13 108.382 176.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.3 t . . . . . 0 C--O 1.243 0.733 0 N-CA-C 108.533 -0.914 . . . . 64.41 108.533 171.777 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 . . . . . 0 N--CA 1.468 0.457 0 N-CA-C 111.428 0.158 . . . . 71.12 111.428 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.537 ' O ' HG23 ' A' ' 11' ' ' VAL . 6.4 mm-40 -58.03 -55.53 33.7 Favored 'General case' 0 C--N 1.347 0.475 0 O-C-N 123.634 0.584 . . . . 72.31 110.13 176.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -33.37 75.81 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 123.099 0.25 . . . . 62.23 111.309 179.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 20.5 mtp180 -65.16 -33.74 76.72 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 122.871 0.468 . . . . 74.42 110.786 178.403 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.423 ' O ' HG23 ' A' ' 14' ' ' VAL . 48.3 mt-30 -68.62 -49.63 57.74 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.362 0.665 . . . . 71.42 109.694 171.643 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.566 HG13 ' HB ' ' A' ' 59' ' ' VAL . 89.9 t -64.16 -46.3 93.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 123.543 0.737 . . . . 62.13 112.562 -171.057 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.475 ' HD3' HG21 ' A' ' 33' ' ' VAL . 50.5 mtmt -64.97 -36.04 83.13 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.364 0.666 . . . . 73.5 110.715 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.565 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 8.8 tt0 -66.43 -55.63 14.83 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.022 -0.99 . . . . 73.12 109.661 177.517 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.504 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 75.5 t -52.9 -43.16 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 123.439 0.695 . . . . 72.23 110.086 177.033 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.87 -45.06 91.05 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-N 115.065 -0.97 . . . . 75.34 111.787 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.414 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 19.6 ptmt -74.48 -28.47 61.03 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.259 -0.428 . . . . 60.12 110.873 -178.776 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 19.2 mm-40 -65.83 -35.78 81.63 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 123.43 0.456 . . . . 73.24 110.144 176.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.607 ' HG3' HG21 ' A' ' 68' ' ' VAL . 28.6 mmmt -73.37 -31.0 63.67 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 115.564 -0.744 . . . . 71.52 110.934 178.321 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.829 ' HB3' HD12 ' A' ' 46' ' ' LEU . 26.6 mt -74.42 -26.68 60.22 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.589 -0.732 . . . . 73.24 111.136 172.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 88.3 mt -77.85 -18.94 55.72 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.24 0.616 . . . . 55.22 110.576 172.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -69.79 -38.38 76.63 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.966 0.506 . . . . 74.2 110.515 170.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -76.38 -35.44 58.64 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 115.649 -0.705 . . . . 74.23 110.569 176.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 37.9 t -158.48 96.1 1.84 Allowed Pre-proline 0 CA--C 1.552 1.057 0 C-N-CA 123.259 0.624 . . . . 60.22 110.168 -176.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -77.96 -15.57 14.77 Favored 'Trans proline' 0 C--N 1.38 2.203 0 C-N-CA 123.057 2.505 . . . . 62.33 113.262 -177.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -88.84 -20.65 24.37 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.871 0.868 . . . . 63.44 111.422 -174.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 83.6 p -82.36 158.71 23.26 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.381 0.672 . . . . 74.12 112.744 -172.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -81.06 120.79 25.26 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.624 -0.717 . . . . 74.25 109.476 167.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 39.6 t -110.52 113.91 45.58 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 N-CA-C 108.254 -1.017 . . . . 74.21 108.254 172.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 56.1 tp60 -108.99 145.51 35.4 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.223 1.009 . . . . 73.35 108.743 177.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.2 p -71.26 127.78 33.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.951 0 N-CA-C 109.457 -0.572 . . . . 73.03 109.457 172.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.4 tpt180 -95.54 -62.11 1.35 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 122.657 0.383 . . . . 73.52 110.076 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -151.97 161.44 42.63 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.146 0.979 . . . . 71.4 109.733 -177.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.475 HG21 ' HD3' ' A' ' 12' ' ' LYS . 88.7 t -137.86 119.09 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 C-N-CA 123.911 0.885 . . . . 71.02 109.841 -176.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.727 ' HB3' HE21 ' A' ' 36' ' ' GLN . 21.1 mp0 -120.74 112.65 19.11 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.108 0.963 . . . . 71.13 109.611 -178.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.548 ' HG2' HG12 ' A' ' 40' ' ' ILE . 12.6 tmtt? -83.18 105.17 13.94 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 108.112 -1.069 . . . . 71.43 108.112 178.329 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.727 HE21 ' HB3' ' A' ' 34' ' ' GLN . 84.6 mm-40 -117.45 93.32 4.12 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.725 0.81 . . . . 71.51 110.167 -173.166 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 74.53 -95.68 0.89 Allowed Glycine 0 C--N 1.346 1.102 0 CA-C-N 116.193 -0.458 . . . . 54.53 112.432 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -118.68 -17.82 9.15 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.584 0.753 . . . . 64.02 109.583 172.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.466 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 11.9 m -93.38 106.03 18.04 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.192 0.997 . . . . 74.01 110.353 -177.348 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.554 HD12 HG21 ' A' ' 11' ' ' VAL . 52.7 mt -80.98 108.29 14.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 N-CA-C 108.968 -0.753 . . . . 64.43 108.968 170.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.546 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 80.8 mtt180 -80.82 100.69 8.94 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.21 -0.905 . . . . 75.13 109.076 174.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 35.9 t -92.38 111.12 23.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 108.356 -0.979 . . . . 62.44 108.356 173.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -77.84 126.02 30.22 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 108.801 -0.814 . . . . 75.12 108.801 167.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -129.78 156.32 44.52 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 108.941 -0.763 . . . . 65.34 108.941 174.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -116.95 106.86 13.88 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.444 1.098 . . . . 74.1 108.652 -174.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.829 HD12 ' HB3' ' A' ' 19' ' ' LEU . 6.9 tt -107.15 140.96 39.17 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 125.172 1.389 . . . . 72.35 108.532 -173.499 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.487 ' HA ' ' HA ' ' A' ' 52' ' ' LYS . 29.9 mtm180 . . . . . 0 N--CA 1.482 1.157 0 N-CA-C 109.49 -0.559 . . . . 72.31 109.49 178.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 47' ' ' ARG . 39.1 ttpt . . . . . 0 N--CA 1.472 0.626 0 N-CA-C 109.56 -0.533 . . . . 61.22 109.56 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -125.3 149.37 48.13 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 123.647 0.779 . . . . 52.55 110.86 -174.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -90.04 118.75 29.83 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.407 -0.815 . . . . 75.14 109.894 176.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -109.14 167.22 10.26 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.929 0.892 . . . . 65.35 109.506 173.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 42.7 m -144.62 105.08 4.11 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 108.538 -0.912 . . . . 75.22 108.538 177.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 42.4 t -92.71 104.98 16.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.621 0 N-CA-C 108.234 -1.024 . . . . 72.11 108.234 179.045 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.546 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 32.1 mt-10 -78.35 106.57 10.37 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 113.88 -1.509 . . . . 73.43 108.58 179.273 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.566 ' HB ' HG13 ' A' ' 11' ' ' VAL . 47.0 t -115.3 113.19 42.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 C-N-CA 123.684 0.794 . . . . 74.11 109.518 -176.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.534 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 32.2 tt0 -102.93 149.37 24.59 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.884 0.874 . . . . 62.13 110.483 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -67.97 129.98 41.58 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.112 0.565 . . . . 63.35 111.05 179.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 56.8 tp60 -119.05 79.86 1.46 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.88 0.872 . . . . 75.12 109.005 175.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 70.46 -100.75 0.83 Allowed Glycine 0 CA--C 1.531 1.065 0 CA-C-N 115.671 -0.695 . . . . 73.13 112.514 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -99.13 -28.0 13.56 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.844 0.857 . . . . 71.13 110.667 -179.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.9 t -100.82 172.13 7.25 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.522 0.729 . . . . 52.21 110.462 -178.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 94.3 m95 -107.52 151.52 25.47 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.485 0.714 . . . . 72.43 109.23 173.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 14.7 t -137.46 149.09 46.58 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.854 0.462 . . . . 64.43 110.631 -179.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.607 HG21 ' HG3' ' A' ' 18' ' ' LYS . 67.2 t -92.46 111.34 24.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 C-N-CA 123.671 0.788 . . . . 72.13 109.639 -175.661 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.534 ' HD3' ' HB3' ' A' ' 60' ' ' GLU . 30.7 mmmt -69.85 -57.84 4.59 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.751 0.82 . . . . 75.44 110.42 177.247 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.0 tpt180 -160.39 135.93 8.16 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.934 -0.575 . . . . 74.43 111.222 -178.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.58 HD11 ' HB3' ' A' ' 18' ' ' LYS . 56.8 mt -89.11 103.84 14.37 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 N-CA-C 107.388 -1.338 . . . . 74.32 107.388 164.226 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 86.0 m -99.89 114.68 28.07 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.488 0.715 . . . . 53.33 109.558 178.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 65.9 ttt180 -72.77 144.9 47.4 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 108.885 -0.783 . . . . 74.23 108.885 169.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 12.2 t . . . . . 0 N--CA 1.475 0.821 0 N-CA-C 108.782 -0.821 . . . . 63.43 108.782 171.566 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.9 ttm . . . . . 0 N--CA 1.475 0.813 0 CA-C-O 118.583 -0.722 . . . . 73.35 109.422 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -57.43 91.9 0.05 OUTLIER 'Trans proline' 0 C--N 1.381 2.272 0 C-N-CA 122.522 2.148 . . . . 74.41 110.903 172.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 48.3 m -72.21 122.19 20.63 Favored 'General case' 0 C--N 1.344 0.365 0 CA-C-N 114.9 -1.045 . . . . 74.15 109.317 -176.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.433 ' O ' ' HD2' ' A' ' 8' ' ' LYS . 28.8 tp10 -52.32 -39.5 60.68 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 124.561 1.163 . . . . 75.41 111.783 -176.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -59.7 -41.03 89.86 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 124.377 1.048 . . . . 72.54 110.167 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.567 ' HA ' ' HD3' ' A' ' 9' ' ' ARG . 34.0 tt0 -74.01 -26.65 60.55 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 114.907 -1.042 . . . . 75.24 110.816 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.46 ' O ' HG23 ' A' ' 11' ' ' VAL . 30.2 mm-40 -64.83 -38.2 90.19 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 119.316 -0.373 . . . . 55.21 110.819 178.598 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.433 ' HD2' ' O ' ' A' ' 4' ' ' GLU . 1.4 mptp? -59.78 -45.94 90.74 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 109.503 -0.555 . . . . 65.21 109.503 174.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.567 ' HD3' ' HA ' ' A' ' 6' ' ' GLU . 74.4 mtp180 -54.36 -42.12 69.94 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 124.144 0.902 . . . . 70.21 111.082 -178.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.408 HE21 ' HA ' ' A' ' 7' ' ' GLU . 48.0 mt-30 -70.84 -52.62 19.19 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.754 0.821 . . . . 74.04 111.306 -179.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.68 HG21 HD12 ' A' ' 40' ' ' ILE . 96.3 t -64.79 -44.99 96.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 124.015 0.926 . . . . 74.12 112.15 -171.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.446 ' HD2' HG11 ' A' ' 30' ' ' VAL . 47.4 mtmt -68.28 -31.63 71.23 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 123.77 0.669 . . . . 64.52 110.704 -179.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.479 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 8.9 tt0 -69.51 -46.35 66.76 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 123.753 0.658 . . . . 71.24 110.033 176.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.487 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 68.8 t -58.67 -45.24 90.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 123.032 0.533 . . . . 61.1 109.631 175.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.508 ' HB1' HD11 ' A' ' 44' ' ' LEU . . . -60.61 -48.43 81.8 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.614 1.165 . . . . 71.02 111.741 -176.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.41 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 20.8 ptmt -67.74 -42.56 81.67 Favored 'General case' 0 C--N 1.351 0.639 0 O-C-N 123.63 0.581 . . . . 75.21 110.47 -178.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 63.3 mm-40 -63.64 -34.67 78.37 Favored 'General case' 0 C--N 1.357 0.932 0 O-C-N 123.62 0.575 . . . . 75.14 111.023 -177.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.495 ' HB3' HD11 ' A' ' 71' ' ' ILE . 65.9 mmtt -64.05 -40.93 97.38 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 123.654 0.596 . . . . 72.44 111.067 176.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.564 HD12 HG11 ' A' ' 28' ' ' VAL . 64.7 mt -70.41 -29.71 66.4 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 116.088 -0.506 . . . . 53.55 111.288 176.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 89.7 mt -77.65 -23.67 49.65 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.835 0.854 . . . . 63.32 110.556 175.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -74.04 -39.51 63.48 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.43 0.692 . . . . 75.35 109.543 172.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -73.38 -31.12 63.73 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 115.784 -0.643 . . . . 73.14 111.426 178.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.8 t -153.65 87.97 3.69 Favored Pre-proline 0 CA--C 1.56 1.362 0 C-N-CA 122.496 0.318 . . . . 52.11 110.307 -176.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -68.03 -17.13 45.96 Favored 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 123.658 2.905 . . . . 64.22 114.812 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -79.81 -17.46 53.29 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-O 121.03 0.443 . . . . 64.33 111.062 178.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 37.1 m -91.65 147.98 22.6 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.683 0.793 . . . . 73.41 111.443 -177.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -109.39 118.78 37.56 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 108.655 -0.868 . . . . 73.12 108.655 172.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.564 HG11 HD12 ' A' ' 19' ' ' LEU . 36.6 t -100.26 144.05 13.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 C-N-CA 124.02 0.928 . . . . 74.14 110.265 -175.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -132.58 147.96 52.36 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.342 1.057 . . . . 70.35 108.488 172.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.446 HG11 ' HD2' ' A' ' 12' ' ' LYS . 57.6 t -67.16 137.04 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.125 0.57 . . . . 74.33 109.975 177.01 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.8 tpt85 -115.7 -39.34 3.53 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.374 0.269 . . . . 73.41 110.965 -173.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.591 ' HB3' ' HB2' ' A' ' 43' ' ' GLU . 0.1 OUTLIER -167.8 144.46 4.17 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 108.551 -0.907 . . . . 54.3 108.551 -174.208 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.544 HG22 HG13 ' A' ' 42' ' ' VAL . 89.8 t -135.08 139.29 47.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 N-CA-C 108.838 -0.801 . . . . 65.22 108.838 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -135.35 113.69 11.47 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.902 0.881 . . . . 73.21 110.711 177.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.504 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 23.9 tptm -81.31 107.7 14.31 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 108.65 -0.871 . . . . 71.33 108.65 172.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -121.93 81.96 1.89 Allowed 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 108.681 -0.859 . . . . 71.24 108.681 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.504 ' O ' ' HE2' ' A' ' 35' ' ' LYS . . . 63.91 -125.65 32.98 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 111.521 -0.632 . . . . 44.12 111.521 -173.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -70.91 -30.47 66.81 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-N 117.524 0.662 . . . . 74.45 111.2 174.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 24.7 m -94.81 110.21 22.1 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 123.245 0.618 . . . . 73.43 111.798 -169.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.68 HD12 HG21 ' A' ' 11' ' ' VAL . 41.1 mt -95.57 113.5 30.1 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 123.799 0.84 . . . . 73.2 110.479 174.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 24.8 mtp-105 -87.88 101.56 13.85 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.286 0.634 . . . . 65.3 109.295 173.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.544 HG13 HG22 ' A' ' 33' ' ' VAL . 48.9 t -97.85 108.36 21.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 N-CA-C 108.763 -0.829 . . . . 73.41 108.763 176.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.591 ' HB2' ' HB3' ' A' ' 32' ' ' ARG . 51.9 mp0 -75.0 129.29 37.39 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 108.867 -0.79 . . . . 71.12 108.867 165.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.508 HD11 ' HB1' ' A' ' 15' ' ' ALA . 3.5 mp -122.72 168.29 12.4 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.878 -0.786 . . . . 72.14 108.878 172.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -126.41 108.63 11.39 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.297 -1.001 . . . . 74.4 108.297 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.416 HD12 ' HB3' ' A' ' 19' ' ' LEU . 6.8 tt -95.92 119.32 34.2 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.377 1.071 . . . . 75.41 108.112 -177.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 84.9 mtm180 -109.27 136.19 49.14 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.498 0.719 . . . . 74.23 109.914 -174.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.528 ' HB ' ' HB2' ' A' ' 51' ' ' LYS . 0.2 OUTLIER -144.71 176.88 9.11 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.634 1.174 . . . . 71.45 109.15 -176.09 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -62.63 98.42 0.12 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.847 0.859 . . . . 70.41 110.815 176.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 77.82 3.24 83.72 Favored Glycine 0 C--N 1.347 1.192 0 CA-C-N 115.746 -0.661 . . . . 71.43 113.868 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.528 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 44.2 mtpt -119.0 149.93 40.81 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.316 0.646 . . . . 52.22 110.317 177.414 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -150.47 99.68 2.79 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 107.223 -1.399 . . . . 75.42 107.223 167.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -104.48 114.82 29.31 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.222 0.609 . . . . 70.24 109.556 -174.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -75.39 117.98 17.78 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.645 -0.872 . . . . 65.14 108.645 171.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -105.92 170.46 7.89 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.646 0.778 . . . . 74.04 109.716 177.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 26.8 m -145.09 102.16 3.71 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 108.028 -1.101 . . . . 72.44 108.028 173.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.42 HG11 ' HA ' ' A' ' 15' ' ' ALA . 61.1 t -93.0 102.92 14.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 N-CA-C 107.019 -1.474 . . . . 71.13 107.019 178.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -89.19 105.3 17.7 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 114.298 -1.319 . . . . 70.42 108.14 -177.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 45.4 t -100.04 152.26 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 125.041 1.337 . . . . 73.54 109.52 -176.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -130.0 144.99 51.63 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.133 0.973 . . . . 70.3 110.207 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.8 tpt180 -81.33 113.04 19.16 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.774 0.83 . . . . 75.31 109.566 175.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 -120.42 100.63 7.27 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 107.998 -1.112 . . . . 72.25 107.998 170.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 72.49 -112.19 3.89 Favored Glycine 0 C--N 1.348 1.2 0 N-CA-C 111.368 -0.693 . . . . 45.25 111.368 -175.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -106.54 -16.13 14.61 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.571 0.748 . . . . 73.5 110.572 174.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 42.2 p -93.37 149.23 21.39 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 122.993 0.517 . . . . 75.35 111.166 -172.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -103.25 116.22 32.04 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.226 1.01 . . . . 75.05 109.905 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.1 t -108.49 145.22 35.04 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.762 0.825 . . . . 54.45 110.435 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.47 HG21 ' HG3' ' A' ' 18' ' ' LYS . 88.7 t -86.23 113.02 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 O-C-N 121.856 -0.527 . . . . 71.13 109.908 179.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.5 mmmp? -66.1 -47.47 74.09 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.913 0.885 . . . . 55.31 110.603 173.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -161.95 154.29 19.59 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.501 -0.772 . . . . 71.33 110.75 -178.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.495 HD11 ' HB3' ' A' ' 18' ' ' LYS . 80.3 mt -113.57 107.24 22.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 107.119 -1.438 . . . . 50.33 107.119 166.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 27.6 m -92.28 144.18 25.65 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.662 0.785 . . . . 72.32 109.063 178.112 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -116.18 148.48 40.32 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 107.21 -1.404 . . . . 74.51 107.21 170.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.1 t -59.6 135.4 57.66 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.452 0.701 . . . . 32.34 109.902 174.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 14.1 p -81.98 135.76 24.33 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 C-N-CA 123.219 0.608 . . . . 72.43 109.622 -177.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -102.62 150.14 17.9 Favored Glycine 0 C--N 1.344 0.985 0 C-N-CA 122.947 0.308 . . . . 54.41 112.492 -178.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 38.9 t -145.78 163.46 34.91 Favored 'General case' 0 C--O 1.248 1.026 0 C-N-CA 124.105 0.962 . . . . 73.04 109.003 175.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -66.4 134.45 52.54 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 108.977 -0.749 . . . . 71.33 108.977 172.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.26 -167.55 1.35 Allowed 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.79 0.836 . . . . 71.45 110.182 -173.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 79.0 t60 -121.49 117.64 27.34 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 107.598 -1.26 . . . . 73.51 107.598 168.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 52.8 m80 -61.96 121.62 13.44 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 109.423 -0.584 . . . . 71.22 109.423 177.199 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 17.5 t60 -71.75 -45.48 61.57 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.625 -0.88 . . . . 53.31 108.625 174.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 15.0 m-70 -87.07 127.34 35.12 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.072 -0.967 . . . . 72.15 109.071 175.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 60.1 m80 -121.75 137.9 54.58 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.297 1.039 . . . . 74.42 108.816 176.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 44.0 t-80 . . . . . 0 C--O 1.247 0.97 0 C-N-CA 123.741 0.816 . . . . 74.42 109.143 179.49 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 mmt . . . . . 0 N--CA 1.483 1.175 0 N-CA-C 110.116 -0.328 . . . . 75.32 110.116 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -72.43 111.9 3.33 Favored 'Trans proline' 0 C--N 1.374 1.904 0 C-N-CA 121.796 1.664 . . . . 72.12 111.087 174.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 64.6 m -113.66 149.64 34.37 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.585 0.754 . . . . 73.12 109.337 176.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -59.8 -30.54 68.98 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.56 0.744 . . . . 72.25 112.025 -175.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -75.7 -35.75 60.21 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.674 0.79 . . . . 72.45 110.645 177.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -70.52 -27.79 64.45 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.747 0.819 . . . . 73.41 110.662 173.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.552 ' O ' HG23 ' A' ' 11' ' ' VAL . 67.8 mm-40 -59.06 -47.31 85.69 Favored 'General case' 0 C--N 1.356 0.875 0 CA-C-O 118.745 -0.645 . . . . 72.12 110.696 -178.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.72 -35.46 72.71 Favored 'General case' 0 C--N 1.364 1.199 0 O-C-N 123.671 0.607 . . . . 43.11 111.022 177.279 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 20.9 mtm180 -65.55 -32.82 74.62 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 122.627 0.371 . . . . 73.42 110.902 178.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.409 ' O ' HG23 ' A' ' 14' ' ' VAL . 41.6 mt-30 -74.36 -38.48 63.19 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 122.99 0.516 . . . . 75.15 110.555 174.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.644 HG21 HD12 ' A' ' 40' ' ' ILE . 58.5 t -70.11 -44.29 78.28 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 C-N-CA 123.493 0.717 . . . . 62.03 111.288 -176.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.467 ' HD3' HG21 ' A' ' 33' ' ' VAL . 45.7 mtmt -63.03 -37.35 86.82 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.911 0.884 . . . . 62.11 110.02 177.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.452 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.3 tt0 -63.28 -55.65 22.98 Favored 'General case' 0 C--N 1.353 0.729 0 O-C-N 124.408 1.067 . . . . 71.14 110.072 177.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.527 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 95.8 t -55.84 -44.24 76.99 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 O-C-N 123.515 0.51 . . . . 61.12 109.941 178.468 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.435 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -60.24 -45.78 92.07 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 124.561 1.144 . . . . 62.24 112.156 -177.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -74.47 -31.98 62.42 Favored 'General case' 0 C--N 1.349 0.582 0 CA-C-N 116.02 -0.536 . . . . 62.45 110.68 -177.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 7.3 mm-40 -64.81 -38.39 90.82 Favored 'General case' 0 C--N 1.352 0.692 0 O-C-N 123.807 0.692 . . . . 75.31 110.014 176.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.527 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 29.0 mmmt -58.94 -49.89 76.14 Favored 'General case' 0 C--N 1.362 1.124 0 O-C-N 123.72 0.637 . . . . 72.52 110.617 176.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.645 ' HB3' HD12 ' A' ' 46' ' ' LEU . 53.1 mt -66.29 -29.26 69.44 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.227 -0.897 . . . . 63.45 112.194 -179.101 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.9 mt -78.86 -27.5 44.08 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.219 0.607 . . . . 54.34 111.078 176.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.445 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 52.7 mt-10 -70.94 -42.87 69.25 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 109.719 -0.474 . . . . 63.43 109.719 174.282 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.44 ' NE2' HD23 ' A' ' 19' ' ' LEU . 47.4 mt-30 -68.64 -41.85 78.83 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 115.168 -0.924 . . . . 74.23 111.001 178.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.2 t -145.58 91.51 5.72 Favored Pre-proline 0 CA--C 1.552 1.054 0 CA-C-N 115.662 -0.699 . . . . 72.12 109.453 -177.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -79.63 -2.85 12.52 Favored 'Trans proline' 0 C--N 1.378 2.102 0 C-N-CA 122.927 2.418 . . . . 55.24 112.15 174.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -95.26 13.93 23.96 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.399 1.08 . . . . 74.32 110.673 -178.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 60.1 p -135.21 148.87 49.77 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.048 0.539 . . . . 64.24 110.871 -175.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.402 ' HE2' ' HA ' ' A' ' 27' ' ' LYS . 11.1 mmpt? -90.3 114.63 26.73 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-O 121.256 0.551 . . . . 74.44 109.925 175.215 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 87.5 t -99.86 124.69 53.43 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 CA-C-N 114.29 -1.323 . . . . 72.23 109.252 -178.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -112.85 167.06 10.81 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.225 1.41 . . . . 63.24 108.157 174.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.41 HG21 ' HB3' ' A' ' 12' ' ' LYS . 87.6 t -104.96 110.92 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 N-CA-C 107.929 -1.137 . . . . 50.33 107.929 169.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -81.89 -43.82 17.65 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 122.767 0.427 . . . . 62.13 111.379 -171.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -162.78 146.21 11.14 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 108.168 -1.049 . . . . 70.23 108.168 -176.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.544 HG13 HG22 ' A' ' 42' ' ' VAL . 40.0 t -118.34 141.22 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 N-CA-C 108.892 -0.781 . . . . 53.14 108.892 177.175 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -135.83 112.74 10.28 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 122.988 0.515 . . . . 73.02 110.241 177.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.413 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 3.2 tmtp? -86.11 117.48 24.97 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 108.349 -0.982 . . . . 74.23 108.349 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -129.23 75.89 1.68 Allowed 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.464 0.706 . . . . 70.4 110.083 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.413 ' O ' ' HE2' ' A' ' 35' ' ' LYS . . . 67.27 -96.99 0.35 Allowed Glycine 0 C--N 1.35 1.335 0 CA-C-N 115.274 -0.875 . . . . 74.31 113.971 173.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.705 ' HB3' ' HG3' ' A' ' 60' ' ' GLU . 16.7 m120 -80.24 -52.58 7.56 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 109.254 -0.647 . . . . 53.12 109.254 173.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 19.8 m -94.84 110.3 22.19 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 114.919 -1.037 . . . . 64.43 110.601 -168.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.644 HD12 HG21 ' A' ' 11' ' ' VAL . 41.9 mt -87.86 107.99 17.99 Favored 'Isoleucine or valine' 0 C--O 1.24 0.568 0 N-CA-C 108.541 -0.911 . . . . 71.52 108.541 169.563 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.56 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 86.8 mtt180 -82.97 96.54 8.35 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 109.0 -0.741 . . . . 61.1 109.0 174.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.544 HG22 HG13 ' A' ' 33' ' ' VAL . 40.7 t -88.29 114.11 26.31 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 107.832 -1.173 . . . . 74.05 107.832 174.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -85.94 107.16 17.6 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.907 0.883 . . . . 74.35 109.411 174.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.2 mp -99.43 170.51 8.57 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.689 0.796 . . . . 74.03 110.761 178.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -130.19 104.04 7.07 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.98 0.912 . . . . 62.45 109.37 -177.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.645 HD12 ' HB3' ' A' ' 19' ' ' LEU . 9.6 tt -104.58 143.96 32.35 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 108.432 -0.951 . . . . 74.52 108.432 -177.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 56.1 mtt85 -110.48 97.59 7.0 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 122.923 0.489 . . . . 61.23 110.814 -177.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 56.1 m -90.36 105.48 17.85 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.404 1.082 . . . . 64.54 109.472 179.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 65.78 27.31 11.16 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.2 1.0 . . . . 72.0 111.117 174.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 92.68 -12.95 68.66 Favored Glycine 0 C--N 1.35 1.343 0 CA-C-N 115.553 -0.749 . . . . 71.35 113.034 -177.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.422 ' HD2' ' N ' ' A' ' 51' ' ' LYS . 10.6 mptt -92.54 151.16 20.32 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.965 0.906 . . . . 73.22 109.487 178.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 33.9 ttpt -99.09 114.88 27.82 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.535 0.734 . . . . 75.21 111.734 -173.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -118.67 113.01 20.54 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 107.826 -1.176 . . . . 73.43 107.826 170.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -81.21 126.07 31.07 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.241 0.616 . . . . 73.41 110.031 177.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -113.06 118.73 35.6 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.198 0.599 . . . . 70.51 109.706 178.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 30.7 m -86.33 102.7 14.24 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.978 0.911 . . . . 63.13 109.093 174.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.465 HG13 HG12 ' A' ' 71' ' ' ILE . 56.0 t -91.54 105.91 17.06 Favored 'Isoleucine or valine' 0 C--O 1.243 0.733 0 N-CA-C 108.633 -0.877 . . . . 72.41 108.633 179.137 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.56 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 24.7 mt-10 -83.84 102.04 12.07 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 125.237 1.415 . . . . 52.32 108.985 -178.015 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.552 HG22 HG22 ' A' ' 68' ' ' VAL . 18.1 t -110.43 123.59 66.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 123.394 0.678 . . . . 70.11 109.373 -177.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.705 ' HG3' ' HB3' ' A' ' 38' ' ' ASN . 39.7 tt0 -102.97 142.97 33.17 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.123 0.969 . . . . 75.42 110.723 -175.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -79.96 111.72 16.57 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 123.584 0.754 . . . . 72.44 109.103 171.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 15.6 mm-40 -116.15 99.26 7.11 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 108.235 -1.024 . . . . 74.15 108.235 171.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.45 -106.07 1.69 Allowed Glycine 0 C--N 1.345 1.053 0 N-CA-C 111.115 -0.794 . . . . 62.44 111.115 -173.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -112.65 -17.57 12.56 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.014 0.926 . . . . 63.14 110.656 174.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 81.0 p -88.36 128.83 35.51 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 122.965 0.506 . . . . 74.45 110.279 -174.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.8 m95 -82.24 131.97 35.23 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.519 0.728 . . . . 73.51 109.287 172.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 8.8 t -132.67 121.12 22.66 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 123.442 0.697 . . . . 73.2 109.785 -175.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.552 HG22 HG22 ' A' ' 59' ' ' VAL . 97.7 t -74.32 104.02 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 123.605 0.762 . . . . 65.52 110.075 -179.244 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -70.0 -50.75 38.43 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.592 0.757 . . . . 74.52 110.754 -177.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 21.4 tpt180 -158.75 147.34 18.5 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.508 -0.769 . . . . 70.24 110.14 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.465 HG12 HG13 ' A' ' 57' ' ' VAL . 65.8 mt -110.55 105.73 19.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 N-CA-C 107.909 -1.145 . . . . 44.44 107.909 172.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 59.9 m -98.93 107.12 19.48 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.786 0.834 . . . . 60.02 110.302 -178.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 30.6 ttp180 -75.01 151.01 38.79 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.516 0.726 . . . . 72.33 110.439 175.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 15.1 t -77.71 151.47 34.16 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 123.399 0.68 . . . . 71.12 109.576 171.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 60.2 t -70.28 105.44 1.37 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.956 0 C-N-CA 123.192 0.597 . . . . 54.55 109.511 178.162 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 179.1 32.73 0.06 OUTLIER Glycine 0 C--N 1.351 1.37 0 O-C-N 123.381 0.426 . . . . 55.43 113.193 -178.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 24.7 m -75.61 140.26 42.52 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.408 0.683 . . . . 72.12 111.251 177.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.1 tt -78.93 102.78 8.46 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 108.38 -0.97 . . . . 73.45 108.38 174.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -67.8 120.28 13.88 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 109.04 -0.726 . . . . 63.44 109.04 174.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 31.4 m80 -81.22 92.16 6.29 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 123.306 0.642 . . . . 71.15 110.832 -169.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 35.0 m170 -73.99 120.54 19.71 Favored 'General case' 0 C--N 1.348 0.509 0 N-CA-C 108.643 -0.873 . . . . 72.51 108.643 173.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 16.1 p80 -115.5 119.19 35.37 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.4 0.68 . . . . 74.32 109.829 -175.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 11.3 t-80 -77.2 -31.37 55.23 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.394 1.078 . . . . 75.32 112.1 -175.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 12.1 p80 -95.47 178.08 5.61 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 122.309 0.243 . . . . 74.13 110.773 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 45.1 t-80 . . . . . 0 C--O 1.249 1.03 0 C-N-CA 123.146 0.578 . . . . 71.23 109.73 176.25 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.3 mmm . . . . . 0 N--CA 1.484 1.227 0 N-CA-C 109.56 -0.533 . . . . 73.33 109.56 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -55.61 92.78 0.04 OUTLIER 'Trans proline' 0 C--N 1.381 2.284 0 C-N-CA 122.433 2.089 . . . . 54.42 111.356 170.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 31.0 m -73.54 158.83 34.12 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-N 115.614 -0.721 . . . . 53.25 110.051 -179.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -64.47 -20.15 66.0 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 122.83 0.452 . . . . 52.33 111.747 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -89.86 -34.3 16.15 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 122.98 0.512 . . . . 74.41 111.15 172.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -66.95 -33.0 74.63 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.536 0.734 . . . . 64.5 111.442 -174.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.56 ' O ' HG23 ' A' ' 11' ' ' VAL . 12.2 pt-20 -59.39 -37.56 78.29 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 115.651 -0.704 . . . . 64.11 110.808 176.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.596 ' HG3' HG11 ' A' ' 33' ' ' VAL . 0.3 OUTLIER -54.84 -39.13 68.26 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 123.627 0.771 . . . . 73.55 111.142 177.925 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.8 mmm180 -62.39 -42.56 99.52 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.708 0.803 . . . . 75.33 109.93 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.447 ' O ' HG23 ' A' ' 14' ' ' VAL . 45.7 mm-40 -66.84 -43.08 84.62 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 114.729 -1.123 . . . . 74.33 110.937 177.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.601 HG21 HD12 ' A' ' 40' ' ' ILE . 63.7 t -67.89 -43.22 86.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 123.854 0.862 . . . . 72.14 111.655 -174.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -63.51 -31.91 73.21 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.029 0.531 . . . . 72.41 110.488 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.438 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 8.7 tt0 -66.71 -52.95 38.74 Favored 'General case' 0 C--N 1.349 0.554 0 O-C-N 123.847 0.717 . . . . 71.1 110.165 174.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 10' ' ' GLN . 66.1 t -59.71 -30.79 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 123.624 0.77 . . . . 64.03 110.804 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.511 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -76.17 -47.12 25.34 Favored 'General case' 0 C--O 1.248 0.992 0 C-N-CA 123.977 0.911 . . . . 62.24 111.992 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -70.59 -33.64 71.29 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 116.054 -0.521 . . . . 64.42 111.514 -172.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 23.1 mm-40 -65.92 -36.99 84.9 Favored 'General case' 0 C--N 1.353 0.753 0 O-C-N 123.789 0.68 . . . . 74.2 110.887 178.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.595 ' HG3' HG21 ' A' ' 68' ' ' VAL . 68.4 mmtt -60.66 -42.89 97.94 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 123.613 0.571 . . . . 62.25 111.303 176.502 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 51.4 mt -72.45 -30.23 64.4 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 115.756 -0.656 . . . . 70.13 111.859 178.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 68.8 mt -70.34 -27.38 64.31 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.204 0.602 . . . . 75.44 111.308 174.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 50.5 mt-10 -70.12 -35.05 73.83 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 120.947 0.403 . . . . 73.31 110.479 174.177 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -83.08 -24.98 32.45 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 115.61 -0.723 . . . . 72.03 111.664 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.0 t -158.56 93.61 1.95 Allowed Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 123.448 0.699 . . . . 45.54 109.394 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_endo -82.06 -9.45 11.76 Favored 'Trans proline' 0 C--N 1.373 1.828 0 C-N-CA 123.142 2.561 . . . . 74.11 113.683 -178.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -85.82 -6.18 59.14 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.263 0.625 . . . . 61.41 111.447 -178.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 64.6 p -114.37 140.54 48.57 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.198 0.999 . . . . 74.1 111.078 -175.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -80.15 127.61 32.52 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.903 -0.777 . . . . 55.5 108.903 171.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.558 HG22 HD12 ' A' ' 46' ' ' LEU . 39.6 t -98.71 112.67 31.4 Favored 'Isoleucine or valine' 0 C--O 1.239 0.532 0 O-C-N 123.535 0.522 . . . . 65.52 109.669 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -99.13 172.98 7.04 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.618 0.767 . . . . 71.42 109.394 175.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.7 p -98.3 132.87 42.47 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 N-CA-C 108.923 -0.769 . . . . 65.41 108.923 171.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.8 tpt180 -88.95 -47.44 8.14 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.399 0.68 . . . . 73.25 109.304 173.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.6 mtt180 -165.02 157.78 16.24 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.319 1.048 . . . . 64.13 109.755 175.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.596 HG11 ' HG3' ' A' ' 8' ' ' LYS . 73.0 t -116.49 110.27 30.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 N-CA-C 108.692 -0.855 . . . . 63.51 108.692 175.353 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -100.99 109.8 21.76 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.172 0.589 . . . . 75.13 109.435 -177.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.3 mmtt -79.69 136.29 36.75 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.915 0.886 . . . . 74.44 109.475 178.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -150.6 67.07 0.94 Allowed 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 107.928 -1.138 . . . . 73.13 107.928 -178.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 67.86 -135.24 30.28 Favored Glycine 0 C--N 1.349 1.277 0 CA-C-N 115.293 -0.867 . . . . 75.52 111.857 -173.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -76.45 -1.14 25.64 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.05 0.54 . . . . 33.32 111.856 176.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 55.1 m -99.84 141.66 32.36 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.462 0.705 . . . . 71.12 109.161 169.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.601 HD12 HG21 ' A' ' 11' ' ' VAL . 59.9 mt -129.79 117.4 41.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 C-N-CA 123.477 0.711 . . . . 53.32 109.222 171.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.424 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 9.8 mtp180 -81.91 97.9 8.28 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 108.684 -0.858 . . . . 74.22 108.684 169.031 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.6 t -80.71 114.19 21.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 N-CA-C 107.973 -1.121 . . . . 74.33 107.973 174.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -86.16 117.57 25.07 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 106.632 -1.618 . . . . 54.43 106.632 169.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.0 mp -111.92 169.84 8.56 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.054 0.454 . . . . 61.2 110.117 -179.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -141.58 107.64 5.19 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.696 0.76 . . . . 61.14 109.16 179.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.558 HD12 HG22 ' A' ' 28' ' ' VAL . 3.0 tt -113.21 135.52 53.73 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.522 1.529 . . . . 72.31 108.492 -173.131 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.425 ' HA ' ' O ' ' A' ' 51' ' ' LYS . 66.5 mtp180 -119.16 103.41 9.5 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-N 117.87 0.305 . . . . 72.21 111.463 -178.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 32.2 m -106.48 123.78 48.61 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.412 0.685 . . . . 73.51 109.982 177.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 62.92 20.22 12.09 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 124.218 1.007 . . . . 75.24 112.067 176.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.71 -21.45 45.88 Favored Glycine 0 C--N 1.35 1.317 0 CA-C-N 116.238 -0.437 . . . . 34.02 112.754 -176.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.425 ' O ' ' HA ' ' A' ' 47' ' ' ARG . 27.6 mmmt -70.68 124.14 23.56 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.395 0.678 . . . . 75.45 110.431 178.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -101.92 100.35 10.65 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 121.546 0.688 . . . . 71.52 109.655 -177.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -108.62 125.55 51.99 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 115.332 -0.849 . . . . 75.33 109.872 -175.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -78.72 146.06 34.14 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.199 0.523 . . . . 63.02 109.709 171.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -132.71 171.12 14.29 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.666 0.786 . . . . 74.1 109.507 177.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.682 ' HB ' ' HB ' ' A' ' 72' ' ' THR . 79.3 m -142.23 104.22 4.41 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 108.174 -1.047 . . . . 55.32 108.174 177.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.511 HG11 ' HA ' ' A' ' 15' ' ' ALA . 99.1 t -99.54 104.82 16.56 Favored 'Isoleucine or valine' 0 C--O 1.239 0.545 0 N-CA-C 107.726 -1.213 . . . . 72.14 107.726 174.281 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.424 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 31.5 mt-10 -82.59 100.21 10.01 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 114.007 -1.451 . . . . 61.52 108.618 -177.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.1 t -100.95 151.17 5.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 124.19 0.996 . . . . 74.42 109.132 -177.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -145.31 135.62 24.04 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 108.753 -0.832 . . . . 71.21 108.753 -175.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 31.1 ttp180 -80.29 133.27 35.95 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.152 0.581 . . . . 73.13 111.998 -172.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 64.3 mm-40 -121.08 109.24 14.8 Favored 'General case' 0 C--O 1.242 0.697 0 N-CA-C 107.515 -1.291 . . . . 73.04 107.515 175.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 67.88 -106.13 1.61 Allowed Glycine 0 C--N 1.345 1.029 0 N-CA-C 110.719 -0.953 . . . . 73.33 110.719 -171.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 54.3 t30 -110.41 -27.28 9.11 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.804 0.842 . . . . 50.44 110.022 172.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 33.9 p -77.75 172.52 13.29 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.163 0.585 . . . . 73.13 110.675 -177.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 89.0 m95 -125.76 146.68 49.67 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.376 0.67 . . . . 71.14 110.371 -175.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 6.1 t -137.75 144.07 41.48 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 122.892 0.477 . . . . 64.15 110.092 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.595 HG21 ' HG3' ' A' ' 18' ' ' LYS . 76.3 t -82.96 118.67 31.04 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 123.072 0.549 . . . . 61.21 109.86 177.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -88.62 -30.99 18.8 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 116.096 -0.502 . . . . 75.4 111.509 177.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 65.5 ttt-85 -158.66 137.17 10.94 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 120.527 0.204 . . . . 63.22 111.292 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 73.3 mt -103.02 131.18 51.88 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 N-CA-C 107.975 -1.121 . . . . 64.15 107.975 168.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.682 ' HB ' ' HB ' ' A' ' 56' ' ' THR . 27.8 m -128.1 150.2 50.07 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.203 1.001 . . . . 43.13 108.976 -177.455 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 27.4 ttp180 -126.41 145.37 50.49 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.079 0.952 . . . . 75.34 108.634 175.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.7 t -69.9 130.85 43.36 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-O 121.111 0.481 . . . . 54.21 110.053 177.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 2.5 p -101.23 103.65 15.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 N-CA-C 108.263 -1.014 . . . . 72.41 108.263 172.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -128.69 29.8 3.91 Favored Glycine 0 N--CA 1.472 1.047 0 CA-C-N 115.948 -0.569 . . . . 52.42 111.704 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 49.9 m -137.06 150.37 48.01 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.696 0.798 . . . . 74.3 109.719 -176.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 59.7 tp -73.62 104.31 4.52 Favored 'General case' 0 C--O 1.24 0.586 0 O-C-N 123.667 0.605 . . . . 54.31 109.624 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -77.87 137.29 38.3 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 123.829 0.852 . . . . 65.22 109.887 175.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -81.08 137.74 35.98 Favored 'General case' 0 C--O 1.241 0.622 0 N-CA-C 109.096 -0.705 . . . . 61.13 109.096 174.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 52.5 m80 -69.38 119.35 13.51 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 108.481 -0.933 . . . . 74.33 108.481 173.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 11.5 p80 -102.4 149.14 24.66 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 109.347 -0.612 . . . . 73.12 109.347 176.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 37.7 m80 -76.42 122.72 24.92 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 108.784 -0.821 . . . . 74.12 108.784 177.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -71.03 -29.09 64.92 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 109.654 -0.498 . . . . 71.31 109.654 174.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 . . . . . 0 C--O 1.249 1.067 0 CA-C-N 115.437 -0.801 . . . . 52.45 109.263 170.634 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.5 ttt . . . . . 0 N--CA 1.481 1.112 0 CA-C-O 118.934 -0.555 . . . . 73.21 110.005 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -64.09 91.82 0.17 Allowed 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.624 2.216 . . . . 74.13 112.259 175.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 39.4 t -152.89 160.45 43.06 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.223 1.009 . . . . 73.3 109.336 -179.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.86 -28.2 40.03 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 109.644 -0.502 . . . . 74.24 109.644 173.295 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -59.88 -34.66 73.45 Favored 'General case' 0 C--N 1.366 1.311 0 C-N-CA 123.973 0.909 . . . . 71.3 110.241 173.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -57.84 -41.6 82.67 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 124.583 1.177 . . . . 63.21 111.495 -177.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.554 ' O ' HG23 ' A' ' 11' ' ' VAL . 7.5 mm-40 -52.09 -52.41 51.46 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 124.295 0.997 . . . . 64.2 110.568 178.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.1 -43.2 96.1 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.17 -0.923 . . . . 74.32 109.811 -177.293 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 25.3 mtm180 -59.78 -35.12 73.99 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.6 0.76 . . . . 71.35 111.708 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.468 ' O ' HG23 ' A' ' 14' ' ' VAL . 46.8 mt-30 -75.12 -55.1 6.07 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.406 0.682 . . . . 72.21 110.511 179.085 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.586 HG13 ' HB ' ' A' ' 59' ' ' VAL . 42.8 t -62.73 -46.01 97.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 123.726 0.81 . . . . 74.23 111.766 -170.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -66.42 -33.4 75.63 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.135 0.574 . . . . 24.51 110.882 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -70.76 -44.34 66.94 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 123.603 0.564 . . . . 64.13 110.214 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.488 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 88.9 t -58.05 -50.35 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 N-CA-C 109.051 -0.722 . . . . 74.41 109.051 175.202 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.494 ' HB1' HD11 ' A' ' 44' ' ' LEU . . . -58.53 -45.91 87.89 Favored 'General case' 0 C--O 1.244 0.786 0 CA-C-N 114.368 -1.287 . . . . 72.41 112.292 -175.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.416 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 22.4 ptmt -69.45 -37.02 77.17 Favored 'General case' 0 C--N 1.353 0.749 0 O-C-N 123.525 0.515 . . . . 74.05 110.46 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.41 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 40.0 mt-10 -64.38 -34.03 77.23 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.319 0.647 . . . . 72.51 111.067 179.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.502 ' HG3' HG21 ' A' ' 68' ' ' VAL . 30.5 mmmt -69.87 -35.49 74.72 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.06 0.457 . . . . 64.54 110.504 178.088 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.759 ' HB3' HD12 ' A' ' 46' ' ' LEU . 41.7 mt -72.61 -23.57 60.96 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 115.257 -0.883 . . . . 74.31 111.299 173.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 96.4 mt -85.18 -17.66 36.47 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.986 0.914 . . . . 75.44 111.462 175.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 15.1 mm-40 -71.91 -44.13 64.2 Favored 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 108.467 -0.938 . . . . 72.25 108.467 169.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -78.52 -32.76 48.21 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 114.732 -1.122 . . . . 64.02 111.322 -177.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.547 ' HB2' HD11 ' A' ' 46' ' ' LEU . 49.0 m -154.83 80.9 4.38 Favored Pre-proline 0 CA--C 1.562 1.408 0 C-N-CA 123.854 0.861 . . . . 61.45 110.368 -173.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.2 -27.07 17.09 Favored 'Trans proline' 0 C--N 1.375 1.957 0 C-N-CA 122.722 2.282 . . . . 72.21 113.308 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.408 HD22 ' N ' ' A' ' 25' ' ' ASN . 0.8 OUTLIER -83.84 -9.67 58.59 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.343 0.657 . . . . 73.53 111.488 -177.566 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 38.0 m -89.34 145.98 25.0 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.274 0.63 . . . . 64.33 111.188 -177.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.424 ' HE2' ' HA ' ' A' ' 27' ' ' LYS . 0.6 OUTLIER -89.29 109.18 20.1 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.6 0.76 . . . . 71.43 109.641 -178.855 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 64.5 t -97.61 122.0 48.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 C-N-CA 124.05 0.94 . . . . 63.42 109.249 -175.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 73.6 mm-40 -101.37 148.44 25.15 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.492 1.117 . . . . 73.22 108.686 177.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 59.0 t -78.58 106.98 10.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 N-CA-C 107.68 -1.23 . . . . 64.35 107.68 166.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.7 tpt180 -82.12 -61.68 1.84 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 122.609 0.364 . . . . 73.02 110.021 -177.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -147.47 170.05 18.22 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 125.177 1.391 . . . . 62.31 109.359 179.064 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.412 HG13 HG22 ' A' ' 42' ' ' VAL . 61.4 t -135.57 114.85 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 N-CA-C 108.134 -1.062 . . . . 70.22 108.134 173.218 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -107.88 110.81 22.67 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.534 0.734 . . . . 70.31 109.219 -179.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.464 ' HG2' HG12 ' A' ' 40' ' ' ILE . 2.5 tmtp? -92.43 108.74 20.19 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 108.602 -0.888 . . . . 71.14 108.602 -176.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -121.31 83.26 2.05 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.492 0.717 . . . . 72.53 110.026 -178.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.77 -108.96 2.66 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 115.206 -0.907 . . . . 72.23 112.889 178.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -93.34 -27.51 16.73 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.334 0.653 . . . . 70.5 110.2 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 32.6 m -93.11 97.72 10.85 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 123.6 0.76 . . . . 65.52 110.489 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.464 HG12 ' HG2' ' A' ' 35' ' ' LYS . 36.0 mt -86.19 107.45 16.58 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 N-CA-C 108.549 -0.908 . . . . 73.54 108.549 173.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 52.0 mtt85 -89.0 96.66 10.82 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.395 1.078 . . . . 70.24 109.797 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.423 HG23 HG12 ' A' ' 11' ' ' VAL . 57.3 t -80.82 124.45 38.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 108.575 -0.898 . . . . 72.03 108.575 175.357 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -90.94 124.09 34.94 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 107.966 -1.124 . . . . 72.15 107.966 174.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.494 HD11 ' HB1' ' A' ' 15' ' ' ALA . 2.0 mp -128.43 150.01 50.31 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 109.156 -0.683 . . . . 74.22 109.156 -179.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -108.81 106.04 15.88 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.376 0.608 . . . . 60.44 109.567 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.759 HD12 ' HB3' ' A' ' 19' ' ' LEU . 9.3 tt -92.68 109.11 20.53 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 107.527 -1.286 . . . . 75.31 107.527 -177.032 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -101.86 124.27 47.21 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.371 1.068 . . . . 71.34 109.59 -175.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.4 ' HB ' ' HB2' ' A' ' 51' ' ' LYS . 4.1 m -126.04 168.99 13.21 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 107.924 -1.139 . . . . 54.41 107.924 176.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -62.85 101.34 0.26 Allowed 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 118.184 0.447 . . . . 52.12 110.755 177.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 95.71 -8.82 68.6 Favored Glycine 0 C--N 1.345 1.045 0 CA-C-N 115.662 -0.699 . . . . 64.52 113.397 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.4 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 43.2 mtmt -114.8 142.0 47.13 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 117.529 0.664 . . . . 54.2 110.8 177.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -136.39 97.99 3.72 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 106.32 -1.733 . . . . 70.45 106.32 168.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -114.19 141.46 47.5 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.66 0.784 . . . . 54.24 109.641 -171.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -111.96 117.0 31.51 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 108.877 -0.786 . . . . 54.15 108.877 174.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -108.1 120.6 42.8 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.65 1.18 . . . . 75.03 110.095 178.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 32.9 m -88.94 101.44 14.07 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 108.775 -0.824 . . . . 73.15 108.775 168.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.545 HG22 HG23 ' A' ' 71' ' ' ILE . 43.0 t -91.88 106.62 17.91 Favored 'Isoleucine or valine' 0 C--O 1.243 0.746 0 N-CA-C 108.554 -0.906 . . . . 54.02 108.554 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -77.38 102.91 7.02 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 114.258 -1.337 . . . . 70.23 108.831 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.586 ' HB ' HG13 ' A' ' 11' ' ' VAL . 27.0 t -111.37 130.31 65.11 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 C-N-CA 123.809 0.844 . . . . 65.31 108.893 -178.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -120.2 141.15 50.17 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.252 0.621 . . . . 74.03 110.758 -173.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -74.59 116.33 15.16 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.487 0.715 . . . . 73.31 110.492 176.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 36.1 mm-40 -117.21 107.28 14.25 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.223 1.009 . . . . 64.03 108.623 171.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 63.18 -115.24 7.75 Favored Glycine 0 C--N 1.348 1.227 0 N-CA-C 111.124 -0.79 . . . . 52.3 111.124 -172.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -91.68 -32.21 15.53 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.504 0.721 . . . . 71.32 109.934 171.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 82.0 p -82.64 173.02 12.31 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.534 0.733 . . . . 61.41 112.129 -168.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -128.66 110.92 12.64 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.141 0.976 . . . . 75.12 110.365 -174.23 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.3 t -93.39 160.65 14.72 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.332 0.653 . . . . 44.31 110.672 177.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.502 HG21 ' HG3' ' A' ' 18' ' ' LYS . 48.1 t -100.42 120.86 50.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 123.203 0.601 . . . . 54.23 109.447 174.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -83.47 -53.07 5.97 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 123.938 0.895 . . . . 75.01 110.618 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 21.5 tpp180 -165.27 144.16 6.47 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.161 0.584 . . . . 63.53 110.422 177.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.545 HG23 HG22 ' A' ' 57' ' ' VAL . 59.2 mt -103.73 105.94 19.31 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 N-CA-C 107.934 -1.136 . . . . 74.44 107.934 172.032 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 57.4 m -97.98 103.89 15.87 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.621 0.769 . . . . 72.53 109.216 -178.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 36.3 ttp180 -85.93 147.4 26.26 Favored 'General case' 0 C--O 1.243 0.724 0 N-CA-C 109.501 -0.555 . . . . 75.32 109.501 175.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 10.0 t -61.89 136.77 58.11 Favored 'General case' 0 CA--C 1.554 1.118 0 O-C-N 123.771 0.669 . . . . 72.44 110.151 171.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 47.4 t -77.03 101.8 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 N-CA-C 108.834 -0.802 . . . . 51.02 108.834 -179.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -69.93 -52.22 20.32 Favored Glycine 0 C--N 1.351 1.382 0 CA-C-N 116.248 -0.433 . . . . 72.02 112.319 -179.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 28.0 m -117.02 111.35 19.43 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 124.302 1.041 . . . . 74.31 108.707 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 53.1 tp -77.62 103.49 7.59 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 109.565 -0.532 . . . . 60.21 109.565 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -77.15 87.37 3.62 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.492 -0.777 . . . . 74.24 109.264 176.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 55.2 t60 -139.08 142.17 38.15 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.535 0.734 . . . . 73.45 109.503 -176.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 -76.47 141.87 41.17 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.95 0.9 . . . . 74.23 110.581 -176.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 75.6 m-70 -86.88 146.21 26.28 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.158 0.583 . . . . 70.55 110.547 -179.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 10.9 p-80 -76.21 159.18 30.9 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.283 0.633 . . . . 74.12 110.676 176.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 47.2 m80 -84.32 -67.32 0.8 Allowed 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 108.632 -0.877 . . . . 65.01 108.632 172.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 . . . . . 0 C--O 1.254 1.333 0 N-CA-C 108.033 -1.099 . . . . 70.23 108.033 177.643 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 mpp? . . . . . 0 N--CA 1.482 1.169 0 N-CA-C 109.813 -0.439 . . . . 65.03 109.813 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -60.72 112.66 1.41 Allowed 'Trans proline' 0 C--N 1.377 2.077 0 C-N-CA 122.593 2.195 . . . . 73.14 111.732 170.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 46.5 p -89.66 31.5 0.93 Allowed 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.574 0.75 . . . . 53.23 111.483 -178.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -72.22 -46.08 57.64 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.002 0.921 . . . . 63.33 109.502 -173.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -69.66 -33.81 73.11 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.772 0.829 . . . . 75.41 110.882 176.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -57.51 -36.23 71.28 Favored 'General case' 0 C--N 1.358 0.955 0 C-N-CA 123.865 0.866 . . . . 74.43 111.672 -176.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.481 ' O ' HG23 ' A' ' 11' ' ' VAL . 44.7 mt-10 -52.4 -52.57 53.09 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 124.322 1.014 . . . . 72.41 110.448 175.609 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.451 ' O ' ' HG3' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -62.38 -42.42 99.4 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 124.545 1.153 . . . . 70.11 109.529 -175.731 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -59.58 -42.66 93.01 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.145 0.978 . . . . 75.42 110.567 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.417 ' O ' HG23 ' A' ' 14' ' ' VAL . 61.7 mt-30 -66.44 -49.79 65.53 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.218 1.007 . . . . 63.32 110.874 177.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.51 HG21 HD12 ' A' ' 40' ' ' ILE . 86.4 t -67.52 -35.27 72.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 124.012 0.925 . . . . 75.12 112.111 -170.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' A' ' 8' ' ' LYS . 53.4 mtmt -60.75 -36.36 78.72 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 122.704 0.402 . . . . 72.41 110.513 176.36 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.449 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 9.8 tt0 -71.39 -49.55 40.95 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 115.421 -0.809 . . . . 71.23 110.07 176.087 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.524 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 67.7 t -55.43 -40.25 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 123.396 0.678 . . . . 61.14 110.487 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.73 -47.64 58.67 Favored 'General case' 0 C--O 1.245 0.865 0 C-N-CA 124.603 1.161 . . . . 74.34 111.745 -176.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.401 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 22.4 ptmt -66.83 -33.92 76.67 Favored 'General case' 0 C--N 1.358 0.952 0 CA-C-N 116.134 -0.485 . . . . 72.4 110.714 -176.057 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.449 ' HG3' ' O ' ' A' ' 13' ' ' GLN . 53.0 mt-10 -61.18 -41.33 96.61 Favored 'General case' 0 C--N 1.36 1.047 0 O-C-N 124.064 0.852 . . . . 71.22 110.599 179.201 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.658 ' HG3' HG21 ' A' ' 68' ' ' VAL . 71.8 mmtt -68.25 -35.2 77.54 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 123.802 0.689 . . . . 61.44 110.825 -178.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 77.6 mt -70.08 -30.04 67.18 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.107 0.563 . . . . 73.34 111.535 173.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 95.1 mt -81.38 -16.77 51.24 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.667 0.787 . . . . 63.51 110.737 175.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -81.2 -46.1 15.36 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 109.427 -0.582 . . . . 73.3 109.427 172.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -71.85 -24.34 61.67 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.291 0.636 . . . . 73.54 111.319 178.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 t -158.01 82.83 2.83 Favored Pre-proline 0 CA--C 1.558 1.273 0 O-C-N 123.421 0.45 . . . . 64.24 110.138 -178.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -61.37 -33.57 88.63 Favored 'Trans proline' 0 C--N 1.381 2.282 0 C-N-CA 123.411 2.741 . . . . 73.52 115.01 -177.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -76.14 -18.45 59.12 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 122.815 0.446 . . . . 65.24 112.103 -175.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 58.3 m -76.64 148.68 36.75 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.381 0.672 . . . . 74.11 111.797 -177.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.512 ' HE3' ' HA ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -103.34 116.33 32.24 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.913 0.885 . . . . 72.34 109.77 174.107 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 51.1 t -99.36 141.24 17.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 CA-C-N 114.705 -1.134 . . . . 75.11 109.525 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -131.63 110.78 11.17 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 108.005 -1.109 . . . . 75.12 108.005 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.451 HG21 ' HB3' ' A' ' 12' ' ' LYS . 73.9 t -58.73 114.57 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 N-CA-C 109.434 -0.58 . . . . 73.14 109.434 178.106 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -92.29 -46.64 7.61 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 123.882 0.739 . . . . 74.1 110.756 -171.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 21.0 tpt180 -157.24 155.33 30.63 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.455 0.702 . . . . 72.23 109.951 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 89.9 t -126.42 141.46 45.83 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 124.33 1.052 . . . . 65.23 109.43 176.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 74.2 mm-40 -128.01 109.17 11.3 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 124.353 1.061 . . . . 65.04 108.931 177.447 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -92.12 110.72 22.1 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 108.084 -1.08 . . . . 71.12 108.084 178.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -122.9 90.28 3.26 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.314 0.646 . . . . 73.1 110.104 -179.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.56 -81.95 0.95 Allowed Glycine 0 C--N 1.35 1.352 0 CA-C-N 116.246 -0.433 . . . . 70.42 112.485 177.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -142.86 1.07 1.27 Allowed 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.695 1.198 . . . . 73.13 110.61 169.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 23.5 m -98.13 97.76 9.15 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.755 -0.831 . . . . 64.21 108.755 174.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.51 HD12 HG21 ' A' ' 11' ' ' VAL . 32.5 mt -92.49 107.66 19.27 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 C-N-CA 123.371 0.669 . . . . 52.31 110.067 178.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.519 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 94.3 mtt180 -87.41 105.26 17.15 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.389 1.076 . . . . 71.14 109.304 174.592 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 50.1 t -96.98 119.51 45.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 N-CA-C 109.086 -0.709 . . . . 72.41 109.086 175.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.484 ' HB3' HD21 ' A' ' 54' ' ' ASN . 7.1 mp0 -83.16 116.58 22.42 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 108.62 -0.882 . . . . 54.13 108.62 170.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.4 mp -116.23 153.64 31.51 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 109.088 -0.708 . . . . 72.04 109.088 176.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -115.76 104.23 11.46 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 124.191 0.996 . . . . 74.02 108.474 -171.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.0 tt -98.95 111.15 23.63 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 108.36 -0.978 . . . . 75.22 108.36 -173.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 57.4 mtt85 -101.3 125.98 48.0 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.664 0.786 . . . . 74.31 110.152 -176.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 90.1 m -148.51 127.34 12.62 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.907 1.283 . . . . 62.03 109.295 -179.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 63.9 21.72 12.74 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 124.828 1.251 . . . . 73.12 112.444 175.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 92.35 -20.34 44.44 Favored Glycine 0 C--N 1.347 1.17 0 CA-C-O 120.13 -0.261 . . . . 53.41 112.466 -176.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -76.48 166.02 23.99 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.979 0.912 . . . . 75.12 110.342 173.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.3 pttt -144.99 141.25 28.78 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.339 0.656 . . . . 75.44 109.669 172.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 49.8 mm-40 -127.38 119.62 26.61 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 107.89 -1.152 . . . . 62.55 107.89 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.484 HD21 ' HB3' ' A' ' 43' ' ' GLU . 8.2 t-20 -83.13 119.19 24.2 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 108.651 -0.87 . . . . 62.25 108.651 175.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -107.88 117.69 34.77 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 124.017 0.927 . . . . 72.01 109.303 177.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 59.0 m -84.43 100.43 11.32 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 107.909 -1.145 . . . . 72.25 107.909 168.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.452 HG22 HG23 ' A' ' 71' ' ' ILE . 57.6 t -91.99 103.83 14.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.447 0 N-CA-C 108.082 -1.081 . . . . 73.43 108.082 -179.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.519 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 30.1 mt-10 -79.01 102.13 8.18 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 114.57 -1.195 . . . . 73.43 108.723 -178.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.661 HG22 HG22 ' A' ' 68' ' ' VAL . 58.7 t -104.39 143.41 16.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 124.275 1.03 . . . . 74.42 108.894 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -136.14 147.83 47.92 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.462 0.705 . . . . 74.3 110.208 -179.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.5 tpp180 -76.57 117.58 18.36 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.785 0.834 . . . . 73.35 110.171 177.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -119.0 126.56 52.02 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 107.592 -1.262 . . . . 71.41 107.592 168.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 65.54 -104.5 1.0 Allowed Glycine 0 C--N 1.346 1.118 0 N-CA-C 111.122 -0.791 . . . . 72.12 111.122 -172.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -127.16 -5.06 6.14 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.89 0.876 . . . . 73.43 110.075 174.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 77.6 p -102.38 174.7 5.79 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.503 0.721 . . . . 73.31 111.171 -176.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -112.39 133.75 54.3 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.557 1.143 . . . . 74.3 110.637 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.1 t -128.23 151.99 48.62 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.26 1.024 . . . . 74.42 108.932 177.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.661 HG22 HG22 ' A' ' 59' ' ' VAL . 77.9 t -92.52 119.25 39.78 Favored 'Isoleucine or valine' 0 C--O 1.241 0.61 0 N-CA-C 109.941 -0.392 . . . . 74.23 109.941 175.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -70.07 -56.79 6.0 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 114.813 -1.085 . . . . 73.3 110.607 173.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -160.62 139.23 10.16 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 123.625 0.578 . . . . 64.4 110.02 178.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.452 HG23 HG22 ' A' ' 57' ' ' VAL . 59.3 mt -89.9 105.43 16.13 Favored 'Isoleucine or valine' 0 C--O 1.239 0.517 0 N-CA-C 107.975 -1.12 . . . . 73.44 107.975 168.292 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 96.1 m -97.14 105.85 18.08 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.485 0.714 . . . . 53.13 109.762 175.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 12.8 ttp180 -71.22 149.28 46.43 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 109.192 -0.67 . . . . 75.3 109.192 172.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 12.0 t -68.61 153.55 43.57 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 109.423 -0.584 . . . . 74.52 109.423 175.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 7.7 p -104.73 146.26 12.2 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 123.389 0.676 . . . . 73.3 109.341 179.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -148.9 138.73 7.08 Favored Glycine 0 C--N 1.337 0.608 0 N-CA-C 109.952 -1.259 . . . . 72.2 109.952 175.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 77.6 p -71.17 116.4 11.43 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.141 0.577 . . . . 55.12 110.213 -175.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.7 tt -106.46 49.7 0.8 Allowed 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 106.8 -1.555 . . . . 63.23 106.8 176.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.14 153.61 37.21 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 114.611 -1.177 . . . . 53.34 109.978 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 51.8 m80 -122.37 125.69 46.43 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 108.449 -0.945 . . . . 62.52 108.449 177.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -92.98 118.97 31.76 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 108.076 -1.083 . . . . 73.13 108.076 176.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -102.2 125.75 48.98 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 109.361 -0.607 . . . . 75.41 109.361 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 14.9 p80 -88.09 2.78 51.18 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.594 0.758 . . . . 65.21 111.512 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 69.0 t60 -103.26 115.68 31.02 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.841 0.856 . . . . 52.34 109.316 174.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 56.6 t-80 . . . . . 0 CA--C 1.557 1.244 0 N-CA-C 109.386 -0.598 . . . . 73.43 109.386 173.618 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 N--CA 1.485 1.288 0 CA-C-O 118.449 -0.786 . . . . 65.32 109.583 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_endo -44.01 110.54 0.21 Allowed 'Trans proline' 0 C--N 1.393 2.891 0 C-N-CA 124.126 3.217 . . . . 73.11 113.946 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 26.5 t -155.93 134.74 11.88 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.242 1.417 . . . . 72.54 107.466 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.493 ' HA ' ' HG2' ' A' ' 7' ' ' GLU . 20.4 tt0 -60.74 -29.0 69.12 Favored 'General case' 0 N--CA 1.481 1.088 0 O-C-N 123.41 0.444 . . . . 74.25 112.079 -170.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -64.88 -45.99 83.66 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.99 0.916 . . . . 75.45 110.676 173.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -66.75 -26.48 67.0 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.397 1.079 . . . . 65.23 110.626 177.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.543 ' O ' HG23 ' A' ' 11' ' ' VAL . 20.2 mm-40 -64.36 -39.73 94.45 Favored 'General case' 0 C--O 1.207 -1.162 0 CA-C-O 118.008 -0.996 . . . . 75.03 111.06 178.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.3 mptt -59.55 -36.4 76.11 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-N 119.319 0.963 . . . . 75.04 110.956 176.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -59.51 -31.33 69.27 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.281 0.632 . . . . 62.31 110.694 176.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.44 ' O ' HG23 ' A' ' 14' ' ' VAL . 38.3 mt-30 -82.45 -47.61 12.04 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 115.444 -0.798 . . . . 64.44 111.887 174.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.579 HG21 HD12 ' A' ' 40' ' ' ILE . 73.1 t -73.1 -45.5 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.186 0 C-N-CA 123.783 0.833 . . . . 54.24 112.08 -165.312 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.637 ' HD2' HG11 ' A' ' 30' ' ' VAL . 25.8 mtmm -69.43 -26.16 64.47 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 109.565 -0.532 . . . . 62.13 109.565 179.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.426 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 23.0 tt0 -71.34 -44.84 64.31 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.2 1.0 . . . . 63.41 110.318 176.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.465 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 82.6 t -61.51 -48.14 90.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 N-CA-C 108.85 -0.796 . . . . 63.01 108.85 174.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.9 -39.84 93.36 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.49 1.116 . . . . 75.24 112.228 -174.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -69.94 -38.05 76.07 Favored 'General case' 0 C--N 1.355 0.826 0 O-C-N 123.263 0.352 . . . . 74.24 110.278 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 28.2 mm-40 -68.23 -34.8 76.89 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 122.743 0.417 . . . . 74.5 110.618 177.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.638 ' HB3' HD11 ' A' ' 71' ' ' ILE . 31.7 mmmt -63.84 -33.0 74.71 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 122.952 0.501 . . . . 70.33 110.813 176.139 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.782 ' HB3' HD12 ' A' ' 46' ' ' LEU . 32.6 mt -76.15 -36.97 58.53 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.733 -0.667 . . . . 73.31 111.532 174.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.0 mt -73.58 -16.38 61.25 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.251 0.62 . . . . 64.13 111.614 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -61.77 -39.5 91.86 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.433 0.635 . . . . 55.3 110.508 167.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.541 HE22 HG21 ' A' ' 71' ' ' ILE . 42.9 mt-30 -84.8 -34.25 22.79 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 114.445 -1.252 . . . . 64.14 110.976 -175.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.425 ' HB3' HD11 ' A' ' 46' ' ' LEU . 15.2 t -153.03 88.81 3.77 Favored Pre-proline 0 CA--C 1.555 1.159 0 N-CA-C 109.169 -0.678 . . . . 71.31 109.169 -177.411 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -62.54 -44.57 17.33 Favored 'Trans proline' 0 C--N 1.384 2.418 0 C-N-CA 123.425 2.75 . . . . 72.3 114.36 -176.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -83.15 -2.99 56.88 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.359 0.663 . . . . 74.23 112.006 -171.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.6 t -83.74 158.39 21.79 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 122.922 0.489 . . . . 71.31 111.218 177.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.34 134.13 35.2 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 123.481 0.712 . . . . 70.12 109.86 177.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.432 ' HA ' ' O ' ' A' ' 45' ' ' GLU . 80.9 t -117.21 113.98 44.35 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 C-N-CA 123.522 0.729 . . . . 65.23 109.912 177.215 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -109.48 122.12 46.7 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.459 1.104 . . . . 60.42 109.062 172.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.637 HG11 ' HD2' ' A' ' 12' ' ' LYS . 57.5 t -65.79 116.33 4.92 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 N-CA-C 109.238 -0.653 . . . . 75.32 109.238 176.042 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.0 tpt180 -83.14 -51.89 7.11 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.389 0.676 . . . . 60.3 110.267 -174.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.401 ' HB2' ' HB2' ' A' ' 43' ' ' GLU . 37.1 mtp85 -146.0 156.4 43.47 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.6 1.16 . . . . 72.24 109.67 -177.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 75.1 t -132.64 117.62 31.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 C-N-CA 123.891 0.876 . . . . 65.3 108.839 175.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -112.91 128.44 56.47 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.21 0.604 . . . . 74.31 110.033 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.5 tptp -108.66 109.76 21.03 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.296 1.039 . . . . 73.2 108.792 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.0 mm-40 -132.1 103.17 6.12 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.426 0.69 . . . . 70.34 109.953 -178.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.34 -101.99 0.89 Allowed Glycine 0 C--N 1.356 1.676 0 CA-C-N 115.92 -0.582 . . . . 74.12 112.519 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -113.22 -23.22 10.07 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.524 0.73 . . . . 75.12 109.715 173.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 16.6 m -85.14 105.71 16.06 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.491 0.716 . . . . 65.21 110.437 -176.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.579 HD12 HG21 ' A' ' 11' ' ' VAL . 31.2 mt -85.46 108.1 16.86 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 N-CA-C 109.29 -0.633 . . . . 73.15 109.29 168.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 -87.71 95.93 10.25 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 108.458 -0.942 . . . . 64.42 108.458 175.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.5 t -88.15 118.38 33.66 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 N-CA-C 108.824 -0.806 . . . . 61.04 108.824 179.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.401 ' HB2' ' HB2' ' A' ' 32' ' ' ARG . 46.3 mt-10 -90.3 120.85 31.79 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 108.605 -0.887 . . . . 73.21 108.605 173.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.5 mp -122.44 170.05 10.36 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 109.728 -0.471 . . . . 65.43 109.728 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.586 ' HG3' ' HG3' ' A' ' 52' ' ' LYS . 29.4 tt0 -120.7 105.16 10.51 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.48 1.112 . . . . 64.34 108.695 -176.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.782 HD12 ' HB3' ' A' ' 19' ' ' LEU . 6.9 tt -107.27 133.83 51.25 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 106.402 -1.703 . . . . 73.53 106.402 172.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 87.1 mtt180 -99.86 96.84 7.84 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.834 0.826 . . . . 74.51 109.66 -174.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 30.2 m -89.76 115.83 27.4 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 114.669 -1.15 . . . . 54.4 109.032 -175.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 64.87 17.75 11.16 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.379 1.072 . . . . 74.52 111.103 -178.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 96.32 -16.96 60.15 Favored Glycine 0 C--N 1.353 1.491 0 CA-C-N 116.196 -0.456 . . . . 63.52 112.917 -175.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -79.39 145.49 33.35 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.738 0.815 . . . . 52.52 110.998 178.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.608 ' HE2' HD21 ' A' ' 54' ' ' ASN . 84.4 tttt -79.64 108.33 13.1 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 122.849 0.46 . . . . 73.43 109.766 175.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -111.89 118.87 36.71 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 107.851 -1.166 . . . . 71.4 107.851 172.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.608 HD21 ' HE2' ' A' ' 52' ' ' LYS . 43.6 m-80 -88.06 132.9 34.11 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 109.878 -0.415 . . . . 44.2 109.878 177.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.439 ' CE2' ' HB3' ' A' ' 46' ' ' LEU . 66.6 m-85 -124.07 119.8 30.55 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 109.167 -0.679 . . . . 62.2 109.167 178.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 26.7 m -87.11 101.9 13.93 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 108.507 -0.923 . . . . 50.32 108.507 173.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.498 HG22 HG23 ' A' ' 71' ' ' ILE . 46.3 t -92.04 104.6 15.75 Favored 'Isoleucine or valine' 0 C--O 1.24 0.595 0 N-CA-C 108.007 -1.109 . . . . 55.4 108.007 177.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -80.93 105.24 12.01 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 114.511 -1.222 . . . . 75.55 109.344 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 20.8 t -112.91 134.57 55.11 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 108.806 -0.812 . . . . 73.43 108.806 178.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -121.95 142.71 50.02 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.302 0.641 . . . . 63.05 111.183 -174.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.85 114.92 19.14 Favored 'General case' 0 C--N 1.35 0.596 0 C-N-CA 123.787 0.835 . . . . 72.25 109.53 174.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -120.84 102.92 8.69 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 107.647 -1.242 . . . . 65.41 107.647 172.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 72.66 -99.53 0.92 Allowed Glycine 0 C--N 1.347 1.177 0 N-CA-C 110.211 -1.156 . . . . 74.43 110.211 -172.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -122.48 -19.19 6.45 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.303 1.041 . . . . 72.02 110.261 169.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 68.1 p -76.79 136.97 38.99 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 122.911 0.485 . . . . 75.22 111.364 -175.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -96.23 111.81 23.75 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.07 0.948 . . . . 75.23 109.891 177.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.2 t -105.01 139.73 39.25 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.734 0.814 . . . . 75.14 109.844 -177.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.488 HG21 ' HG3' ' A' ' 18' ' ' LYS . 59.0 t -91.14 116.65 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 O-C-N 121.709 -0.619 . . . . 71.43 110.379 177.198 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -71.37 -57.38 4.51 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.532 1.133 . . . . 54.13 111.091 175.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -162.09 133.53 5.29 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.584 -0.734 . . . . 50.5 109.844 -173.031 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.638 HD11 ' HB3' ' A' ' 18' ' ' LYS . 56.5 mt -91.48 105.21 16.3 Favored 'Isoleucine or valine' 0 C--O 1.241 0.614 0 N-CA-C 106.636 -1.616 . . . . 73.33 106.636 163.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 27.2 m -101.25 108.46 20.12 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.108 -0.701 . . . . 61.23 109.108 -176.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -67.54 138.67 56.68 Favored 'General case' 0 C--O 1.241 0.625 0 N-CA-C 108.81 -0.811 . . . . 74.02 108.81 171.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.1 t -60.02 156.53 14.59 Favored 'General case' 0 C--O 1.247 0.934 0 C-N-CA 123.58 0.752 . . . . 73.25 110.605 175.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 85.0 t -61.42 99.72 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.348 0.5 0 N-CA-C 108.826 -0.805 . . . . 72.23 108.826 177.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -96.98 -139.12 10.45 Favored Glycine 0 C--N 1.34 0.795 0 CA-C-N 115.024 -0.989 . . . . 74.01 111.064 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 31.4 t -154.1 162.22 41.35 Favored 'General case' 0 C--O 1.248 1.015 0 N-CA-C 108.437 -0.949 . . . . 53.34 108.437 176.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.0 pp -57.92 137.17 56.98 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 109.436 -0.579 . . . . 64.14 109.436 172.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -78.35 148.67 33.65 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 109.747 -0.464 . . . . 75.31 109.747 -175.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -63.59 104.95 0.71 Allowed 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 107.99 -1.115 . . . . 73.41 107.99 174.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 35.2 p-80 -61.34 118.38 6.85 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 124.277 0.985 . . . . 60.24 111.822 -167.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 32.9 p-80 -78.91 -9.66 59.57 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 115.047 -0.979 . . . . 64.45 110.154 172.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 81.2 t60 -57.9 109.09 0.67 Allowed 'General case' 0 C--N 1.359 1.011 0 C-N-CA 124.665 1.186 . . . . 72.22 109.669 168.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 34.2 m80 -133.81 103.08 5.69 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 123.683 0.793 . . . . 75.22 110.105 -176.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 47.6 t60 . . . . . 0 CA--C 1.556 1.173 0 N-CA-C 107.881 -1.155 . . . . 72.24 107.881 176.356 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 119.065 -0.493 . . . . 70.33 109.842 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -56.49 121.82 10.71 Favored 'Trans proline' 0 C--N 1.377 2.05 0 C-N-CA 121.897 1.731 . . . . 62.51 110.864 168.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.569 ' O ' ' HG3' ' A' ' 7' ' ' GLU . 22.3 t -60.84 -23.85 65.44 Favored 'General case' 0 C--O 1.212 -0.87 0 C-N-CA 123.229 0.612 . . . . 64.14 110.61 178.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.2 tp10 -51.33 -47.22 62.77 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.134 1.374 . . . . 75.41 111.651 173.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -75.2 -39.86 59.79 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.201 0.6 . . . . 75.51 110.403 177.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.424 ' HA ' ' HD2' ' A' ' 9' ' ' ARG . 11.7 tp10 -66.47 -22.17 66.2 Favored 'General case' 0 C--O 1.245 0.816 0 CA-C-N 115.108 -0.951 . . . . 74.23 111.312 -176.277 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.569 ' HG3' ' O ' ' A' ' 3' ' ' SER . 72.9 mt-10 -50.5 -66.74 0.34 Allowed 'General case' 0 C--N 1.364 1.205 0 O-C-N 124.022 0.826 . . . . 70.35 109.981 173.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.478 ' HD2' ' HB2' ' A' ' 7' ' ' GLU . 10.6 mptt -66.0 -27.82 68.42 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 123.908 0.755 . . . . 70.22 111.295 -169.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.424 ' HD2' ' HA ' ' A' ' 6' ' ' GLU . 90.5 mtt180 -59.71 -40.14 86.94 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.091 0.556 . . . . 72.52 110.398 176.295 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -77.91 -51.38 10.51 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 115.107 -0.951 . . . . 64.43 110.751 173.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.546 HG23 ' O ' ' A' ' 7' ' ' GLU . 52.0 t -66.04 -44.77 91.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 123.653 0.781 . . . . 64.43 112.486 -164.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.403 ' HD2' HG11 ' A' ' 30' ' ' VAL . 29.1 mtmm -66.05 -31.97 73.16 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 123.165 0.29 . . . . 71.42 110.394 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.412 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 8.4 tt0 -70.76 -43.82 68.01 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 124.107 0.879 . . . . 74.3 110.185 178.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.479 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 87.8 t -65.08 -39.83 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 N-CA-C 109.557 -0.534 . . . . 64.14 109.557 176.023 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.91 -44.2 81.37 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.198 0.999 . . . . 71.51 111.598 -175.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -67.85 -34.82 77.45 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 123.793 0.683 . . . . 75.44 110.164 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.484 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 22.4 mm-40 -61.01 -46.02 92.46 Favored 'General case' 0 C--N 1.356 0.848 0 O-C-N 123.633 0.583 . . . . 65.54 111.077 177.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.607 ' HB3' HD11 ' A' ' 71' ' ' ILE . 71.5 mmtt -67.22 -30.66 70.65 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.669 0.606 . . . . 75.45 111.09 -178.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.565 ' HB3' HD12 ' A' ' 46' ' ' LEU . 41.7 mt -70.15 -36.26 74.62 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.396 0.678 . . . . 64.24 111.442 174.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.3 mt -76.06 -22.89 55.15 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 123.764 0.826 . . . . 55.21 110.57 176.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 7.4 mm-40 -69.15 -36.94 77.97 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.261 0.624 . . . . 75.14 110.147 171.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -76.16 -42.06 47.86 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.21 0.604 . . . . 73.12 110.944 176.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.4 t -148.85 96.71 3.75 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 123.062 0.545 . . . . 73.12 110.368 -174.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -82.55 -1.98 10.83 Favored 'Trans proline' 0 C--N 1.372 1.805 0 C-N-CA 123.228 2.619 . . . . 71.4 112.434 172.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -83.41 -3.88 57.97 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.671 1.188 . . . . 61.11 111.676 178.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 34.4 p -127.09 142.56 51.49 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 123.382 0.673 . . . . 74.42 111.979 -168.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -77.85 136.43 38.07 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 123.818 0.699 . . . . 73.25 109.587 169.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 60.3 t -112.61 134.99 53.43 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 C-N-CA 123.973 0.909 . . . . 74.03 108.938 177.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -128.95 149.6 50.73 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.826 0.851 . . . . 70.11 109.396 176.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.403 HG11 ' HD2' ' A' ' 12' ' ' LYS . 73.8 t -77.05 110.35 12.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 N-CA-C 109.96 -0.385 . . . . 73.54 109.96 176.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -81.44 -59.57 2.58 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.656 0.782 . . . . 63.12 110.09 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.424 ' HB2' ' HB2' ' A' ' 43' ' ' GLU . 17.6 mmm180 -148.82 167.26 26.12 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.885 1.274 . . . . 70.2 108.981 -176.276 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.403 HG22 HG13 ' A' ' 42' ' ' VAL . 59.2 t -135.45 139.76 46.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 N-CA-C 108.704 -0.85 . . . . 62.13 108.704 171.179 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -125.6 108.25 11.39 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 109.112 -0.699 . . . . 75.04 109.112 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -96.43 113.51 25.1 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 107.972 -1.122 . . . . 74.04 107.972 176.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 92.4 mm-40 -131.96 99.05 4.61 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.879 -0.786 . . . . 74.51 108.879 176.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 63.06 -102.53 0.53 Allowed Glycine 0 C--N 1.348 1.238 0 O-C-N 124.386 1.054 . . . . 72.3 112.908 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.493 HD22 ' HB3' ' A' ' 61' ' ' ARG . 18.1 m120 -97.15 -39.76 9.13 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.571 0.748 . . . . 63.22 109.838 174.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.438 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 11.5 m -80.69 96.42 6.9 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 123.296 0.638 . . . . 60.31 110.803 -172.061 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 28.8 mt -87.54 107.32 17.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 115.779 -0.646 . . . . 64.02 109.357 168.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 31.6 mtm180 -87.82 96.07 10.33 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 108.01 -1.107 . . . . 72.22 108.01 174.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.403 HG13 HG22 ' A' ' 33' ' ' VAL . 48.6 t -82.59 121.17 35.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 N-CA-C 109.034 -0.728 . . . . 74.41 109.034 177.073 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.424 ' HB2' ' HB2' ' A' ' 32' ' ' ARG . 37.6 mt-10 -89.45 118.11 28.86 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.416 -0.811 . . . . 74.15 109.095 176.116 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.8 mp -122.99 164.04 19.29 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 108.823 -0.806 . . . . 74.12 108.823 176.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -125.56 111.82 15.48 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.633 0.773 . . . . 70.52 108.916 -169.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.565 HD12 ' HB3' ' A' ' 19' ' ' LEU . 8.5 tt -120.41 137.68 54.18 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.173 1.389 . . . . 62.14 108.361 -171.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 14.5 mtm180 -101.18 97.83 8.31 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 109.476 -0.565 . . . . 74.22 109.476 -178.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 8.0 m -82.35 105.25 13.27 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.2 0.6 . . . . 62.13 110.054 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 50.0 m-20 59.07 34.37 23.39 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.527 1.131 . . . . 73.01 111.783 177.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 96.73 -17.07 59.92 Favored Glycine 0 C--N 1.349 1.274 0 CA-C-N 115.865 -0.607 . . . . 75.23 113.488 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -85.79 121.07 27.92 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 117.511 0.655 . . . . 71.54 109.626 177.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -86.78 98.43 11.16 Favored 'General case' 0 C--O 1.241 0.629 0 N-CA-C 108.983 -0.747 . . . . 71.21 108.983 -176.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -108.59 134.61 51.11 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.907 0.883 . . . . 72.13 110.399 -175.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -88.43 120.87 30.21 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.633 -0.712 . . . . 74.54 110.525 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.517 ' CE2' ' HB3' ' A' ' 46' ' ' LEU . 19.1 m-85 -104.71 157.8 16.94 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.02 0.928 . . . . 65.31 109.801 177.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 85.3 m -134.23 103.04 5.59 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 107.984 -1.117 . . . . 70.33 107.984 173.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.43 HG22 HG23 ' A' ' 71' ' ' ILE . 52.0 t -90.1 105.25 16.01 Favored 'Isoleucine or valine' 0 C--O 1.241 0.647 0 N-CA-C 107.56 -1.274 . . . . 74.32 107.56 -179.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -77.12 111.27 12.54 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 114.891 -1.049 . . . . 62.31 109.129 -179.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 24.7 t -122.81 122.59 66.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 123.635 0.774 . . . . 51.01 109.39 -178.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.438 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 29.8 tt0 -105.85 145.57 31.05 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.114 0.965 . . . . 72.3 110.859 -176.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.493 ' HB3' HD22 ' A' ' 38' ' ' ASN . 14.5 tpp180 -75.42 121.25 22.02 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 109.782 -0.451 . . . . 75.1 109.782 171.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -117.39 101.8 8.7 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.503 -0.925 . . . . 72.14 108.503 167.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.75 -106.24 1.76 Allowed Glycine 0 C--N 1.348 1.239 0 CA-C-N 115.96 -0.564 . . . . 64.32 111.98 -178.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -108.98 -19.71 13.3 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.342 0.657 . . . . 64.32 110.296 177.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.2 p -93.76 173.88 7.46 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.465 0.65 . . . . 70.24 111.442 -178.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -116.08 150.55 37.15 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.479 1.111 . . . . 73.15 109.442 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.3 t -134.77 123.15 23.14 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 109.457 -0.571 . . . . 72.34 109.457 -179.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.557 HG21 ' HG3' ' A' ' 18' ' ' LYS . 95.5 t -74.93 103.67 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 N-CA-C 108.812 -0.81 . . . . 72.24 108.812 175.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.5 mmmp? -64.4 -52.77 56.54 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 123.934 0.894 . . . . 74.03 110.196 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -163.62 152.61 14.17 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.464 -0.789 . . . . 64.3 109.895 178.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.607 HD11 ' HB3' ' A' ' 18' ' ' LYS . 70.5 mt -101.95 110.14 27.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 N-CA-C 108.029 -1.1 . . . . 72.04 108.029 170.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 17.4 m -91.65 142.8 27.23 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 108.542 -0.91 . . . . 54.01 108.542 178.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 27.9 ttp180 -118.31 144.33 45.93 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 107.536 -1.283 . . . . 63.21 107.536 168.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.4 t -58.28 144.79 40.01 Favored 'General case' 0 C--O 1.248 0.996 0 C-N-CA 122.943 0.497 . . . . 75.53 109.994 176.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 58.8 t -60.69 99.83 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 N-CA-C 108.621 -0.881 . . . . 63.45 108.621 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -139.55 7.36 3.06 Favored Glycine 0 CA--C 1.51 -0.232 0 CA-C-N 114.642 -1.163 . . . . 71.55 110.746 176.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 16.6 m -68.3 84.1 0.25 Allowed 'General case' 0 C--N 1.353 0.747 0 C-N-CA 124.264 1.026 . . . . 42.11 110.004 177.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.86 153.72 40.91 Favored 'General case' 0 C--O 1.244 0.802 0 CA-C-N 115.379 -0.828 . . . . 72.05 110.746 179.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -67.17 140.23 57.48 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.794 -0.639 . . . . 52.51 111.158 -175.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 45.5 p-80 -137.66 147.26 44.76 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-N 115.148 -0.933 . . . . 71.53 108.862 174.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 50.6 m80 -72.84 150.43 42.69 Favored 'General case' 0 C--O 1.242 0.704 0 C-N-CA 123.577 0.751 . . . . 74.1 111.747 -175.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 38.2 t60 -66.72 101.02 0.75 Allowed 'General case' 0 C--N 1.346 0.445 0 CA-C-N 115.135 -0.938 . . . . 73.33 108.818 171.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 78.6 m80 -58.31 143.26 45.4 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.837 0.855 . . . . 75.03 110.206 177.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 48.2 t-80 66.32 87.32 0.12 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.486 1.114 . . . . 70.01 108.931 -170.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 11.8 p80 . . . . . 0 C--O 1.253 1.289 0 C-N-CA 123.616 0.766 . . . . 61.12 110.021 -172.706 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.2 ttm . . . . . 0 N--CA 1.481 1.105 0 N-CA-C 109.042 -0.725 . . . . 73.24 109.042 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -80.92 82.6 2.42 Favored 'Trans proline' 0 C--N 1.373 1.852 0 C-N-CA 122.753 2.302 . . . . 72.02 112.164 178.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.515 ' HB3' ' HG3' ' A' ' 6' ' ' GLU . 38.6 t -66.43 137.28 56.73 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-N 115.843 -0.617 . . . . 75.4 109.764 177.078 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -68.4 -19.8 64.63 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 115.943 -0.572 . . . . 42.33 111.224 179.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -66.55 -36.74 83.4 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.886 0.874 . . . . 71.24 110.706 173.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.515 ' HG3' ' HB3' ' A' ' 3' ' ' SER . 45.2 mt-10 -59.41 -33.57 71.4 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.39 0.676 . . . . 74.35 110.348 177.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.509 ' O ' HG23 ' A' ' 11' ' ' VAL . 51.1 mm-40 -63.47 -40.93 98.42 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 123.899 0.749 . . . . 75.13 111.35 178.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.19 -41.65 98.55 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.247 0.619 . . . . 61.55 110.32 179.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -58.83 -44.79 90.97 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 124.026 0.93 . . . . 72.12 110.822 175.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.452 ' O ' HG23 ' A' ' 14' ' ' VAL . 68.5 mt-30 -62.96 -45.11 93.97 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 114.904 -1.044 . . . . 74.44 111.089 179.249 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.52 HG21 HD12 ' A' ' 40' ' ' ILE . 87.6 t -66.71 -43.51 90.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 123.621 0.769 . . . . 73.34 111.423 -176.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -61.45 -37.69 84.49 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 123.486 0.491 . . . . 75.54 110.442 176.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.512 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.5 tt0 -65.79 -49.14 69.38 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 124.119 0.887 . . . . 74.43 110.323 179.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 10' ' ' GLN . 89.0 t -58.12 -45.69 88.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 C-N-CA 123.068 0.547 . . . . 62.34 109.784 176.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.84 -42.29 97.63 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.175 0.99 . . . . 51.41 112.179 -175.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -73.72 -35.44 65.09 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 116.317 -0.401 . . . . 72.34 110.667 -176.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 25.3 mm-40 -65.87 -37.13 85.33 Favored 'General case' 0 C--N 1.353 0.732 0 O-C-N 123.422 0.451 . . . . 75.33 110.369 176.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.634 ' HB3' HD11 ' A' ' 71' ' ' ILE . 65.9 mmtt -63.26 -37.1 85.94 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.347 0.659 . . . . 74.53 110.897 176.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 23.8 mt -72.49 -30.65 64.71 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 115.85 -0.614 . . . . 64.42 111.414 176.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 75.5 mt -76.19 -19.68 58.2 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.333 0.653 . . . . 64.31 111.045 177.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -77.0 -21.12 55.17 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.018 0.527 . . . . 71.22 110.714 170.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 -88.64 -38.12 15.06 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.165 0.586 . . . . 73.25 110.226 175.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.8 t -157.31 102.51 1.87 Allowed Pre-proline 0 CA--C 1.552 1.048 0 C-N-CA 124.208 1.003 . . . . 42.32 109.215 -176.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -77.04 -27.61 6.69 Favored 'Trans proline' 0 C--N 1.373 1.824 0 C-N-CA 122.796 2.331 . . . . 74.24 112.851 -176.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -74.46 -27.93 60.8 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.766 0.826 . . . . 62.54 111.18 -173.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 54.5 m -80.47 130.04 34.9 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 123.299 0.64 . . . . 74.13 111.373 -174.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -73.67 123.49 24.15 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 123.509 0.724 . . . . 75.14 109.697 175.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.54 HG22 HD12 ' A' ' 46' ' ' LEU . 40.8 t -99.68 113.29 34.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 123.315 0.646 . . . . 74.34 109.617 -177.074 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -94.61 151.72 19.09 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.945 -0.761 . . . . 52.11 108.945 174.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 p -87.09 105.75 15.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 N-CA-C 108.936 -0.765 . . . . 62.44 108.936 171.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -77.21 -42.7 36.41 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.249 0.62 . . . . 72.41 110.435 -177.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 17.5 tpp85 -170.01 155.55 5.63 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.976 0.91 . . . . 61.31 109.452 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 25.2 t -117.21 117.19 54.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.354 -0.98 . . . . 70.15 108.354 171.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -104.55 145.59 30.09 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 109.423 -0.584 . . . . 61.22 109.423 174.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.565 ' HG2' HG12 ' A' ' 40' ' ' ILE . 13.2 tmtt? -136.53 117.25 13.99 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 107.166 -1.42 . . . . 74.13 107.166 -177.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -133.25 96.3 3.71 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.082 0.953 . . . . 63.51 108.733 -175.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.47 -92.76 0.28 Allowed Glycine 0 C--N 1.348 1.248 0 O-C-N 123.555 0.535 . . . . 72.53 112.215 -177.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.435 HD22 ' HB3' ' A' ' 61' ' ' ARG . 19.3 m120 -114.18 -25.23 8.57 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.971 0.909 . . . . 75.23 110.741 175.079 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.567 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 19.9 m -81.79 103.8 11.73 Favored 'General case' 0 C--O 1.24 0.587 0 C-N-CA 123.158 0.583 . . . . 75.11 111.252 -176.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.565 HG12 ' HG2' ' A' ' 35' ' ' LYS . 39.6 mt -86.76 107.12 16.54 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 N-CA-C 109.063 -0.717 . . . . 63.31 109.063 168.4 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.425 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 95.0 mtt180 -92.29 96.72 10.45 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 108.406 -0.961 . . . . 73.34 108.406 176.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.412 HG12 ' HG ' ' A' ' 44' ' ' LEU . 39.2 t -80.25 120.7 32.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 N-CA-C 108.421 -0.955 . . . . 54.34 108.421 176.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -84.89 115.49 22.8 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 107.482 -1.303 . . . . 74.53 107.482 170.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.412 ' HG ' HG12 ' A' ' 42' ' ' VAL . 1.9 mp -117.82 142.87 46.82 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 109.594 -0.521 . . . . 73.5 109.594 178.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -107.2 104.82 14.55 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.916 0.886 . . . . 72.02 108.787 -175.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.54 HD12 HG22 ' A' ' 28' ' ' VAL . 8.3 tt -117.2 135.46 53.77 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.323 1.049 . . . . 60.3 108.747 -175.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 64.6 mtm180 -103.0 97.74 7.8 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 109.306 -0.627 . . . . 73.33 109.306 -178.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 89.1 m -76.35 96.44 4.0 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.655 0.782 . . . . 74.32 109.761 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 60.85 27.17 17.0 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.245 1.018 . . . . 61.03 111.328 -178.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 99.72 -8.09 59.67 Favored Glycine 0 C--N 1.354 1.537 0 CA-C-N 115.58 -0.736 . . . . 70.43 113.74 -179.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.513 ' HA ' ' HE2' ' A' ' 51' ' ' LYS . 11.0 mmpt? -83.75 124.23 30.67 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 117.402 0.601 . . . . 70.23 109.468 174.095 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -81.47 109.49 15.99 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.079 0.551 . . . . 73.21 110.208 -175.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -127.64 118.78 24.51 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.775 0.83 . . . . 72.2 109.815 -177.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -80.32 147.07 31.27 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.812 -0.81 . . . . 62.1 108.812 171.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 -129.88 120.57 25.13 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.762 0.825 . . . . 55.24 108.829 179.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 90.8 m -85.44 100.64 12.01 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 108.404 -0.962 . . . . 71.21 108.404 170.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.483 HG22 HG23 ' A' ' 71' ' ' ILE . 43.4 t -97.52 102.87 13.99 Favored 'Isoleucine or valine' 0 C--O 1.243 0.728 0 N-CA-C 107.591 -1.263 . . . . 72.25 107.591 175.075 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.425 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 31.7 mt-10 -80.57 101.52 9.21 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 114.319 -1.31 . . . . 73.24 108.483 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.502 ' HB ' HG13 ' A' ' 11' ' ' VAL . 21.2 t -109.39 109.45 28.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 N-CA-C 107.84 -1.17 . . . . 71.01 107.84 177.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.567 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 45.8 tt0 -101.9 146.34 27.97 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.729 0.811 . . . . 75.41 109.767 -175.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.435 ' HB3' HD22 ' A' ' 38' ' ' ASN . 8.6 tpt180 -80.49 111.24 16.72 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.659 0.784 . . . . 73.11 110.595 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 -106.11 93.5 4.65 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 108.398 -0.964 . . . . 55.23 108.398 174.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.08 -100.69 0.73 Allowed Glycine 0 C--N 1.344 1.011 0 CA-C-N 115.549 -0.75 . . . . 44.45 112.045 -177.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -105.65 -26.08 11.99 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.23 1.012 . . . . 73.41 110.831 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.2 p -93.61 160.65 14.68 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.579 0.752 . . . . 73.13 111.686 -174.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -108.16 109.81 21.3 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.625 1.17 . . . . 74.41 109.821 176.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 9.8 t -103.83 127.67 51.31 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.67 0.788 . . . . 71.14 110.712 -178.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.467 HG22 HG22 ' A' ' 59' ' ' VAL . 63.6 t -77.51 110.14 12.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 N-CA-C 109.617 -0.512 . . . . 64.01 109.617 176.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -69.05 -49.52 56.81 Favored 'General case' 0 C--O 1.24 0.58 0 C-N-CA 123.363 0.665 . . . . 74.11 110.534 178.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -166.69 143.1 4.66 Favored 'General case' 0 C--N 1.348 0.501 0 CA-C-N 116.291 -0.413 . . . . 73.2 111.49 177.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.634 HD11 ' HB3' ' A' ' 18' ' ' LYS . 56.8 mt -97.84 106.95 19.37 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 N-CA-C 107.739 -1.208 . . . . 73.13 107.739 166.442 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 37.4 m -102.51 119.73 39.31 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.307 0.643 . . . . 75.41 109.48 178.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 28.4 ttp180 -75.93 148.08 38.47 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 109.331 -0.618 . . . . 74.43 109.331 176.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.4 t -54.2 137.15 41.52 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 124.394 1.078 . . . . 71.14 112.616 -173.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 45.9 t -69.27 103.51 0.84 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.606 0 CA-C-N 115.382 -0.826 . . . . 63.13 108.946 176.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 163.72 -37.84 0.32 Allowed Glycine 0 C--O 1.239 0.438 0 N-CA-C 109.47 -1.452 . . . . 75.22 109.47 -172.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 20.9 t -87.92 178.01 6.81 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 123.689 0.796 . . . . 63.41 109.913 172.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.3 tt -136.24 117.67 14.74 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 108.141 -1.059 . . . . 70.35 108.141 -177.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -79.94 97.67 6.84 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 107.995 -1.113 . . . . 33.13 107.995 172.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 29.5 p80 -64.79 154.13 37.89 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.8 0.44 . . . . 74.01 111.765 -170.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 72.2 m-70 -69.82 153.59 43.12 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.519 0.728 . . . . 72.43 111.389 -176.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -96.55 119.11 34.44 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.088 -0.96 . . . . 60.43 109.003 -175.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 41.4 t60 -70.09 108.02 3.91 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 108.587 -0.894 . . . . 73.23 108.587 174.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 14.3 p80 -67.5 125.84 27.42 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 122.672 0.389 . . . . 62.11 110.211 -175.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 21.7 p80 . . . . . 0 C--O 1.251 1.146 0 CA-C-N 116.038 -0.528 . . . . 73.04 109.848 174.256 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.1 mmt . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 119.353 -0.356 . . . . 71.53 110.452 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -56.42 -39.04 93.97 Favored 'Trans proline' 0 C--N 1.383 2.361 0 C-N-CA 123.238 2.626 . . . . 60.21 112.792 175.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 29.8 m -83.84 104.73 14.17 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.451 -0.795 . . . . 70.11 109.344 177.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -78.65 -36.54 43.77 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.083 0.953 . . . . 71.24 110.73 -174.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -67.21 -35.52 79.78 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-O 120.948 0.404 . . . . 60.44 110.221 178.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -51.35 -42.0 60.99 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.04 1.336 . . . . 65.14 111.769 -178.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.506 ' O ' HG23 ' A' ' 11' ' ' VAL . 9.8 mm-40 -57.42 -43.32 83.7 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.987 0.915 . . . . 72.43 111.914 -175.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.454 ' HD2' ' N ' ' A' ' 8' ' ' LYS . 10.5 mptt -68.76 -48.21 64.3 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 108.872 -0.788 . . . . 74.12 108.872 -179.276 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -59.13 -34.53 72.16 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.697 1.199 . . . . 61.25 112.117 -177.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -70.89 -53.62 14.45 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.633 0.773 . . . . 72.22 110.817 178.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.64 HG13 ' HB ' ' A' ' 59' ' ' VAL . 59.8 t -63.36 -44.59 99.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 123.27 0.628 . . . . 75.31 111.639 -172.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.607 ' HD2' HG11 ' A' ' 30' ' ' VAL . 48.2 mtmt -66.02 -33.8 76.63 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.396 0.679 . . . . 74.31 110.592 -179.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.509 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.4 tt0 -66.45 -59.11 3.97 Favored 'General case' 0 C--N 1.355 0.811 0 O-C-N 123.96 0.788 . . . . 63.34 109.699 176.215 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.4 t -52.49 -44.77 45.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 C-N-CA 124.435 1.094 . . . . 70.4 111.129 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.431 ' HB1' HD11 ' A' ' 44' ' ' LEU . . . -61.69 -42.05 98.41 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.282 1.033 . . . . 62.22 111.646 -179.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.407 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 32.3 tttm -65.54 -43.72 89.09 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.441 1.096 . . . . 61.3 110.719 175.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 15.7 mm-40 -61.24 -41.91 97.71 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 123.843 0.715 . . . . 74.15 110.573 -177.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.433 ' HB3' HD11 ' A' ' 71' ' ' ILE . 69.6 mmtt -64.56 -41.52 96.26 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 124.196 0.935 . . . . 75.11 110.966 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.451 HD23 ' NE2' ' A' ' 22' ' ' GLN . 77.3 mt -70.17 -27.61 64.66 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.0 0.52 . . . . 75.01 111.733 177.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 90.6 mt -73.63 -33.89 64.75 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.436 0.694 . . . . 40.12 110.36 174.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -71.1 -36.68 72.26 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.475 0.71 . . . . 74.13 110.783 177.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.451 ' NE2' HD23 ' A' ' 19' ' ' LEU . 24.2 mt-30 -76.43 -35.55 58.45 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.558 0.743 . . . . 74.42 111.457 178.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 29.8 t -148.24 93.74 4.35 Favored Pre-proline 0 CA--C 1.55 0.971 0 N-CA-C 109.433 -0.58 . . . . 70.23 109.433 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -76.0 -4.07 14.67 Favored 'Trans proline' 0 C--N 1.378 2.119 0 C-N-CA 122.792 2.328 . . . . 71.42 112.867 173.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.455 HD22 ' N ' ' A' ' 25' ' ' ASN . 0.7 OUTLIER -83.07 -19.46 36.8 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.055 0.942 . . . . 73.54 110.059 173.627 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.441 ' HA ' ' HB ' ' A' ' 48' ' ' THR . 39.4 t -86.45 141.02 29.43 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 123.386 0.675 . . . . 75.52 112.325 -173.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -89.87 108.93 20.0 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 107.3 -1.37 . . . . 74.13 107.3 164.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 88.6 t -98.48 113.37 32.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 C-N-CA 123.82 0.848 . . . . 74.34 109.206 -176.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 61.3 tp60 -117.87 124.21 47.75 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.578 0.751 . . . . 75.43 109.811 -178.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.607 HG11 ' HD2' ' A' ' 12' ' ' LYS . 55.8 t -62.8 108.1 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 N-CA-C 109.309 -0.626 . . . . 75.43 109.309 174.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 24.1 tpt85 -88.43 -36.27 16.6 Favored 'General case' 0 CA--C 1.549 0.915 0 CA-C-N 115.28 -0.873 . . . . 72.24 111.607 -175.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -170.0 165.49 9.44 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.328 0.651 . . . . 71.11 109.336 -177.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.499 HG21 ' HD3' ' A' ' 12' ' ' LYS . 97.5 t -141.69 123.44 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 124.012 0.925 . . . . 72.51 109.594 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -101.31 109.99 21.92 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.209 0.604 . . . . 72.41 109.537 170.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.512 ' HG2' HG12 ' A' ' 40' ' ' ILE . 6.2 tmtm? -99.09 108.53 21.19 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 108.303 -0.999 . . . . 64.35 108.303 179.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -126.99 99.4 5.7 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.804 0.842 . . . . 73.41 110.413 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.04 -120.78 17.06 Favored Glycine 0 C--N 1.356 1.654 0 CA-C-N 115.322 -0.854 . . . . 73.23 112.641 176.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -77.05 -35.03 57.11 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.521 0.728 . . . . 74.11 110.654 178.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.458 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 89.5 m -87.95 126.39 35.03 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-O 121.319 0.58 . . . . 65.42 110.216 -175.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.512 HG12 ' HG2' ' A' ' 35' ' ' LYS . 33.3 mt -115.27 107.94 24.07 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 N-CA-C 107.836 -1.172 . . . . 54.3 107.836 173.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.582 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 94.4 mtt180 -83.31 131.62 35.07 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 123.905 0.882 . . . . 75.14 108.674 173.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.483 HG13 HG22 ' A' ' 33' ' ' VAL . 35.5 t -118.81 116.83 52.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 108.634 -0.876 . . . . 74.11 108.634 175.247 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -83.68 103.68 13.19 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 107.869 -1.159 . . . . 75.21 107.869 172.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.434 ' HG ' HG12 ' A' ' 42' ' ' VAL . 0.6 OUTLIER -109.6 166.85 10.58 Favored 'General case' 0 N--CA 1.484 1.235 0 N-CA-C 107.963 -1.125 . . . . 71.13 107.963 173.458 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -122.12 125.83 47.03 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.816 0.341 . . . . 72.35 110.255 -173.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.4 ' HG ' ' OG ' ' A' ' 26' ' ' SER . 10.0 tt -96.85 115.57 27.66 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.911 1.284 . . . . 70.51 107.692 -177.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -120.79 105.92 11.19 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.962 0.905 . . . . 74.02 110.222 -177.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.441 ' HB ' ' HA ' ' A' ' 26' ' ' SER . 12.7 t -158.72 135.69 9.73 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.146 0.579 . . . . 74.21 110.057 176.19 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 60.95 22.83 12.98 Favored 'General case' 0 N--CA 1.499 2.017 0 C-N-CA 124.227 1.011 . . . . 65.54 112.534 176.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 85.91 2.36 86.37 Favored Glycine 0 C--N 1.354 1.58 0 CA-C-O 119.956 -0.358 . . . . 41.31 113.396 -176.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 2.1 mmmp? -84.49 127.11 33.85 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.882 0.873 . . . . 74.42 108.75 174.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -136.04 99.15 4.06 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 107.579 -1.267 . . . . 74.44 107.579 -178.078 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -138.32 130.97 29.32 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.862 0.865 . . . . 63.13 109.78 -178.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 35.6 m-80 -83.4 127.23 33.51 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.352 0.661 . . . . 53.31 110.61 178.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -106.5 119.98 40.72 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.985 0.914 . . . . 72.44 109.351 176.239 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 80.5 m -86.7 101.7 13.53 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 124.762 1.225 . . . . 62.32 108.817 172.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.546 HG22 HG23 ' A' ' 71' ' ' ILE . 45.5 t -93.31 105.45 16.84 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 N-CA-C 108.437 -0.949 . . . . 63.24 108.437 179.124 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.582 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 33.6 mt-10 -77.94 112.15 14.54 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.796 0.839 . . . . 61.25 108.774 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.64 ' HB ' HG13 ' A' ' 11' ' ' VAL . 17.6 t -124.66 115.31 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 N-CA-C 108.573 -0.899 . . . . 33.34 108.573 177.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.459 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 29.4 tt0 -100.7 148.3 25.03 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.069 0.948 . . . . 74.34 110.233 -176.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.12 114.13 19.76 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 109.262 -0.644 . . . . 73.12 109.262 176.161 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 -119.81 86.61 2.59 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 124.275 1.03 . . . . 65.15 108.276 177.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 68.55 -132.37 27.17 Favored Glycine 0 C--N 1.346 1.101 0 CA-C-N 115.692 -0.685 . . . . 61.14 111.631 -175.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -80.59 -2.17 45.25 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.714 0.806 . . . . 55.13 111.721 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 73.8 p -114.56 150.96 34.16 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.084 0.554 . . . . 74.45 110.563 -176.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 96.3 m95 -98.32 119.18 36.55 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.056 0.942 . . . . 75.42 108.827 168.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 10.0 t -103.13 121.29 42.32 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.442 0.697 . . . . 72.0 109.875 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 51.2 t -76.29 106.97 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 108.494 -0.928 . . . . 75.22 108.494 176.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.459 ' HD3' ' HB3' ' A' ' 60' ' ' GLU . 1.5 mmmp? -65.02 -57.13 9.49 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 115.589 -0.732 . . . . 61.35 110.128 -179.352 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 63.1 ttt180 -167.26 136.25 2.71 Favored 'General case' 0 C--N 1.352 0.676 0 CA-C-N 116.008 -0.542 . . . . 75.24 110.597 178.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.546 HG23 HG22 ' A' ' 57' ' ' VAL . 71.9 mt -87.35 105.91 15.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 107.653 -1.24 . . . . 73.41 107.653 171.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 19.6 m -107.07 115.5 30.29 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.341 0.656 . . . . 75.54 109.506 -174.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -68.84 149.9 48.42 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.015 0.526 . . . . 71.52 109.753 172.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.8 t -59.37 153.98 17.8 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.791 0.837 . . . . 73.51 110.202 167.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 3.5 p -65.48 100.4 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.173 0 CA-C-O 121.714 0.769 . . . . 50.15 109.178 174.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -137.21 -21.01 0.55 Allowed Glycine 0 C--N 1.344 0.981 0 CA-C-N 114.87 -1.059 . . . . 51.42 111.961 -178.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.9 t -69.45 129.66 40.33 Favored 'General case' 0 C--N 1.349 0.554 0 N-CA-C 109.536 -0.542 . . . . 63.24 109.536 176.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 68.5 tp -60.28 -38.56 83.97 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.724 0.81 . . . . 53.51 110.995 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -77.44 4.97 9.73 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.515 0.726 . . . . 63.35 112.362 -174.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -45.7 107.41 0.1 Allowed 'General case' 0 C--N 1.366 1.32 0 C-N-CA 124.097 0.959 . . . . 74.1 111.156 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 32.3 m-70 -65.51 142.91 57.97 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-N 114.745 -1.116 . . . . 61.11 109.266 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 31.2 m-70 -63.23 95.76 0.09 Allowed 'General case' 0 N--CA 1.476 0.855 0 O-C-N 123.856 0.722 . . . . 74.34 110.058 -174.03 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 77.8 t60 -167.05 125.28 1.32 Allowed 'General case' 0 C--O 1.24 0.601 0 C-N-CA 125.213 1.405 . . . . 72.15 107.811 -174.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -93.81 143.59 26.19 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 123.701 0.801 . . . . 73.22 109.061 176.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 42.1 t-80 . . . . . 0 C--O 1.254 1.33 0 N-CA-C 108.8 -0.815 . . . . 72.04 108.8 173.897 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.3 mtm . . . . . 0 N--CA 1.484 1.236 0 N-CA-C 108.618 -0.882 . . . . 74.34 108.618 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -57.6 -47.5 21.23 Favored 'Trans proline' 0 C--N 1.387 2.575 0 C-N-CA 123.63 2.887 . . . . 70.11 112.914 -176.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.4 m -85.12 102.37 13.21 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 108.466 -0.939 . . . . 62.41 108.466 175.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.14 -19.67 61.74 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 122.766 0.426 . . . . 71.13 110.933 175.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -54.58 -26.34 31.81 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 124.324 1.049 . . . . 53.1 112.641 167.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -57.58 -37.78 73.76 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 123.75 0.656 . . . . 54.24 110.802 174.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -64.22 -40.96 97.14 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 116.196 -0.456 . . . . 73.33 111.097 177.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.554 ' HG3' HG11 ' A' ' 33' ' ' VAL . 1.0 OUTLIER -62.49 -42.41 99.48 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 123.713 0.633 . . . . 63.3 110.016 177.755 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 41.8 ttt180 -56.77 -44.31 81.7 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.776 0.831 . . . . 74.33 111.131 177.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.524 ' O ' HG23 ' A' ' 14' ' ' VAL . 46.4 mt-30 -68.92 -45.97 69.49 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 114.929 -1.032 . . . . 72.12 110.945 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.61 HG21 HD12 ' A' ' 40' ' ' ILE . 55.1 t -70.84 -43.47 76.96 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 124.065 0.946 . . . . 74.34 112.243 -173.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -61.66 -36.05 79.72 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.171 0.588 . . . . 71.34 110.168 176.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.508 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 8.8 tt0 -64.22 -52.51 58.47 Favored 'General case' 0 C--N 1.354 0.764 0 O-C-N 124.088 0.867 . . . . 74.41 110.21 176.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.525 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 84.9 t -55.25 -44.43 75.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 123.137 0.575 . . . . 63.54 110.22 178.057 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.01 -47.91 75.79 Favored 'General case' 0 C--O 1.248 1.017 0 C-N-CA 124.664 1.186 . . . . 52.31 112.52 -176.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.415 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 14.8 ptmm? -68.1 -35.8 78.74 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 115.564 -0.744 . . . . 71.31 110.854 -175.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 38.9 mm-40 -62.5 -40.09 95.58 Favored 'General case' 0 C--N 1.353 0.727 0 O-C-N 123.772 0.67 . . . . 74.14 111.25 179.191 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.525 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 13.9 mmmm -64.45 -40.14 95.16 Favored 'General case' 0 CA--C 1.551 1.008 0 O-C-N 123.425 0.453 . . . . 74.1 110.85 178.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.497 HD23 ' NE2' ' A' ' 22' ' ' GLN . 81.9 mt -71.74 -29.47 64.56 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.98 0.912 . . . . 71.25 112.42 177.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 90.4 mt -73.63 -33.72 64.67 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.44 0.696 . . . . 73.51 110.256 175.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 50.0 mt-10 -66.63 -31.75 72.63 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.527 0.731 . . . . 64.02 110.776 173.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.497 ' NE2' HD23 ' A' ' 19' ' ' LEU . 48.7 mt-30 -77.56 -41.14 40.03 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.324 0.65 . . . . 65.1 111.587 176.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.0 t -144.7 88.78 6.92 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 122.788 0.435 . . . . 75.44 110.085 -176.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -75.46 -15.93 19.48 Favored 'Trans proline' 0 C--N 1.38 2.202 0 C-N-CA 123.393 2.729 . . . . 54.23 113.153 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -81.79 -13.86 57.16 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.39 0.676 . . . . 72.01 110.601 174.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 67.2 m -98.11 137.56 36.7 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.241 0.617 . . . . 51.24 110.521 176.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -84.72 117.17 23.65 Favored 'General case' 0 C--O 1.243 0.724 0 N-CA-C 107.808 -1.182 . . . . 74.44 107.808 166.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 66.5 t -99.21 112.43 31.39 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 O-C-N 123.501 0.501 . . . . 74.14 109.876 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -97.62 178.01 5.31 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.01 0.924 . . . . 74.32 108.897 174.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.2 p -105.99 125.52 61.52 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 N-CA-C 109.624 -0.51 . . . . 74.01 109.624 173.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.8 tpt180 -83.08 -59.03 2.61 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 109.281 -0.636 . . . . 55.33 109.281 178.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 21.5 mtm180 -146.14 166.31 26.54 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.466 1.106 . . . . 74.14 109.74 176.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.554 HG11 ' HG3' ' A' ' 8' ' ' LYS . 60.9 t -130.02 111.59 21.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 N-CA-C 107.401 -1.333 . . . . 43.5 107.401 176.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 24.8 tp60 -107.41 109.93 21.77 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 118.008 0.367 . . . . 72.01 110.185 -177.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -78.29 137.14 37.93 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 108.626 -0.879 . . . . 65.32 108.626 170.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -143.55 82.65 1.74 Allowed 'General case' 0 C--O 1.242 0.662 0 N-CA-C 108.593 -0.892 . . . . 63.13 108.593 -177.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.54 -79.11 0.82 Allowed Glycine 0 C--N 1.348 1.242 0 CA-C-N 115.443 -0.799 . . . . 45.22 112.565 -178.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -131.98 -18.38 2.67 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.108 0.963 . . . . 72.01 110.994 174.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.511 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 7.0 m -85.21 116.74 23.74 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 122.78 0.432 . . . . 75.1 109.889 177.605 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.61 HD12 HG21 ' A' ' 11' ' ' VAL . 32.4 mt -91.0 106.35 17.44 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 N-CA-C 108.988 -0.745 . . . . 61.13 108.988 169.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 35.2 mtp180 -89.06 94.46 9.95 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 108.11 -1.07 . . . . 74.22 108.11 175.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.3 t -85.97 114.52 25.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 N-CA-C 108.971 -0.752 . . . . 72.31 108.971 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -84.12 109.63 17.86 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 108.024 -1.102 . . . . 73.24 108.024 172.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.5 mp -104.04 169.08 8.71 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 122.974 0.509 . . . . 50.13 110.286 177.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 57.8 tt0 -121.2 105.29 10.44 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.174 0.989 . . . . 75.44 109.151 -175.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.2 tt -101.09 110.79 22.85 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 108.102 -1.073 . . . . 74.24 108.102 -177.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 72.4 mtt180 -103.47 101.12 11.0 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.756 0.423 . . . . 74.53 110.806 -175.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 89.8 m -90.44 99.92 12.86 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.664 0.786 . . . . 62.12 110.84 176.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 18.9 m120 57.86 37.89 27.02 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 124.555 1.142 . . . . 71.12 112.027 175.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.15 -17.28 58.88 Favored Glycine 0 C--N 1.351 1.385 0 CA-C-N 115.344 -0.844 . . . . 75.35 113.314 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -81.26 123.88 28.86 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 117.602 0.701 . . . . 75.12 110.939 176.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -92.42 125.25 36.99 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.233 1.013 . . . . 64.44 110.057 -177.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -139.77 118.73 12.56 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 108.483 -0.932 . . . . 55.54 108.483 175.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -88.57 138.45 31.42 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 122.791 0.436 . . . . 73.31 111.355 -175.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -123.8 119.41 29.63 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.565 0.746 . . . . 75.43 109.209 178.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 28.2 m -86.42 100.13 12.13 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 109.391 -0.596 . . . . 74.1 109.391 175.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.467 HG22 HG23 ' A' ' 71' ' ' ILE . 45.9 t -93.31 104.21 15.49 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 N-CA-C 107.48 -1.304 . . . . 71.0 107.48 179.411 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -84.74 101.72 12.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.717 -1.129 . . . . 73.2 108.864 -176.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.538 ' HB ' HG13 ' A' ' 11' ' ' VAL . 21.6 t -106.65 111.26 34.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 124.067 0.947 . . . . 63.23 108.517 177.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.511 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 33.8 tt0 -100.97 150.13 23.2 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.523 0.729 . . . . 55.12 110.54 -175.165 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -68.16 106.28 2.36 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.355 0.662 . . . . 65.33 109.653 174.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 56.0 tp60 -92.83 85.96 5.35 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 108.43 -0.952 . . . . 73.35 108.43 173.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.02 -98.47 0.56 Allowed Glycine 0 C--N 1.348 1.244 0 N-CA-C 111.335 -0.706 . . . . 55.34 111.335 -174.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -101.53 -34.69 9.44 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.076 0.95 . . . . 72.04 109.98 176.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 65.0 p -84.87 175.97 8.78 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.827 0.851 . . . . 75.13 111.956 -174.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -114.05 139.39 49.33 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.565 1.146 . . . . 71.54 109.895 176.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 8.8 t -133.27 132.53 41.52 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.623 0.769 . . . . 73.44 110.109 -179.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.432 HG22 HG22 ' A' ' 59' ' ' VAL . 88.8 t -74.77 106.83 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 108.823 -0.806 . . . . 72.54 108.823 173.311 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 2.9 mmmp? -63.46 -52.03 63.16 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.689 1.196 . . . . 73.33 109.857 175.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 19.1 tpt180 -175.67 144.43 0.65 Allowed 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.105 -0.952 . . . . 75.11 109.675 178.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.467 HG23 HG22 ' A' ' 57' ' ' VAL . 35.6 mt -88.38 110.56 21.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 N-CA-C 108.194 -1.039 . . . . 53.45 108.194 168.32 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 30.7 m -91.96 106.98 18.88 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.99 -0.745 . . . . 75.3 108.99 177.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 52.6 ttt180 -68.82 129.44 39.95 Favored 'General case' 0 C--O 1.244 0.816 0 N-CA-C 108.23 -1.026 . . . . 70.21 108.23 169.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 15.3 t -60.51 131.42 50.69 Favored 'General case' 0 C--O 1.246 0.889 0 O-C-N 123.774 0.671 . . . . 62.33 110.857 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 5.4 p -73.92 102.92 2.04 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.15 0 N-CA-C 108.917 -0.772 . . . . 74.05 108.917 175.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -145.57 3.31 1.16 Allowed Glycine 0 N--CA 1.479 1.515 0 CA-C-N 115.204 -0.907 . . . . 61.3 112.453 175.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 47.7 t -129.02 134.09 47.99 Favored 'General case' 0 C--O 1.244 0.771 0 C-N-CA 124.577 1.151 . . . . 64.22 108.369 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -77.19 104.13 7.51 Favored 'General case' 0 C--O 1.243 0.726 0 N-CA-C 108.408 -0.96 . . . . 75.32 108.408 178.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -69.61 90.63 0.57 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.952 0.901 . . . . 72.43 110.142 -177.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 -54.2 112.08 0.9 Allowed 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 113.985 -1.462 . . . . 70.41 111.215 178.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 9.7 p80 -126.34 134.69 51.02 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.707 0.803 . . . . 74.4 109.657 -175.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 11.0 p80 -144.89 162.35 37.07 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 122.939 0.495 . . . . 51.41 110.709 -173.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 61.7 m-70 -100.5 173.23 6.66 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.061 0.944 . . . . 74.34 108.602 171.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -87.42 -96.33 0.09 Allowed 'General case' 0 CA--C 1.554 1.124 0 CA-C-O 118.246 -0.883 . . . . 73.5 110.006 175.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 20.8 m80 . . . . . 0 N--CA 1.494 1.762 0 N-CA-C 108.641 -0.874 . . . . 73.01 108.641 174.331 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.481 1.088 0 CA-C-O 119.03 -0.509 . . . . 72.21 109.93 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.83 90.8 0.04 OUTLIER 'Trans proline' 0 C--N 1.382 2.319 0 C-N-CA 123.047 2.498 . . . . 75.53 112.431 171.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.46 ' O ' ' HG3' ' A' ' 7' ' ' GLU . 35.1 p -126.36 -51.25 1.51 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.029 1.332 . . . . 55.31 109.542 -177.215 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.06 -36.69 77.89 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.045 1.338 . . . . 70.43 112.388 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -83.97 -34.72 24.33 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 122.64 0.376 . . . . 54.45 110.682 176.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -61.87 -29.41 70.17 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.681 0.792 . . . . 73.3 111.209 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 3' ' ' SER . 52.0 mt-10 -48.11 -53.57 16.17 Favored 'General case' 0 C--N 1.363 1.179 0 C-N-CA 124.074 0.949 . . . . 63.45 110.127 173.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.527 ' HG3' HG11 ' A' ' 33' ' ' VAL . 0.4 OUTLIER -56.22 -45.09 80.06 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 124.905 1.378 . . . . 74.51 109.732 -175.898 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -62.89 -38.12 89.63 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.97 0.908 . . . . 75.02 111.356 -177.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -75.02 -44.58 47.17 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.698 0.799 . . . . 55.01 110.9 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.441 HG11 ' HB ' ' A' ' 40' ' ' ILE . 90.6 t -76.41 -32.76 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.179 0.992 . . . . 63.14 112.301 -169.166 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.409 ' HG3' ' O ' ' A' ' 8' ' ' LYS . 9.1 mtmp? -61.32 -37.92 85.0 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 109.685 -0.487 . . . . 74.45 109.685 173.009 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.535 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 7.8 tt0 -67.54 -52.08 43.16 Favored 'General case' 0 C--N 1.352 0.717 0 O-C-N 124.248 0.968 . . . . 71.34 110.123 176.025 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.463 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 72.2 t -54.97 -39.88 51.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 123.223 0.609 . . . . 73.14 110.62 179.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.426 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -66.62 -48.42 69.55 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 115.363 -0.835 . . . . 74.11 112.078 -178.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -71.34 -34.9 70.94 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 123.713 0.633 . . . . 72.23 111.769 -174.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.535 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 20.7 mm-40 -61.63 -43.4 98.92 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 123.404 0.44 . . . . 62.32 110.623 -179.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.573 ' HG3' HG21 ' A' ' 68' ' ' VAL . 2.2 mmmp? -64.18 -42.79 96.55 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 123.759 0.662 . . . . 73.42 110.011 178.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.499 ' HB3' HD12 ' A' ' 46' ' ' LEU . 40.5 mt -63.0 -34.89 78.52 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.76 0.824 . . . . 75.32 112.563 177.515 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 85.1 mt -77.21 -26.41 52.7 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.389 0.676 . . . . 74.21 111.62 -177.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 12.5 mm-40 -69.87 -36.62 75.63 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 109.909 -0.404 . . . . 74.4 109.909 171.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -77.28 -31.37 54.77 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.312 1.045 . . . . 71.02 111.462 178.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.9 m -146.28 83.15 8.61 Favored Pre-proline 0 CA--C 1.56 1.35 0 C-N-CA 123.705 0.802 . . . . 72.14 109.935 -174.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -75.71 -21.26 14.75 Favored 'Trans proline' 0 C--N 1.375 1.951 0 C-N-CA 123.138 2.558 . . . . 64.41 112.127 177.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -86.57 15.28 5.71 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.326 1.05 . . . . 53.4 111.18 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 46.9 t -120.2 152.78 37.21 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.476 0.711 . . . . 62.11 111.207 -176.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.89 108.96 20.73 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 107.73 -1.211 . . . . 75.02 107.73 174.339 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.3 t -97.46 116.83 40.92 Favored 'Isoleucine or valine' 0 C--O 1.239 0.552 0 C-N-CA 123.508 0.723 . . . . 71.01 110.061 -176.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -101.59 161.94 13.27 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.578 1.151 . . . . 74.22 108.345 171.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 59.2 t -87.48 113.85 25.48 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 N-CA-C 107.834 -1.173 . . . . 51.42 107.834 169.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -81.89 -45.27 15.7 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.397 0.679 . . . . 63.4 110.111 -176.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 29.8 tpt180 -167.66 157.01 10.01 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 124.03 0.932 . . . . 65.14 109.145 177.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.527 HG11 ' HG3' ' A' ' 8' ' ' LYS . 58.0 t -120.87 130.58 74.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 123.464 0.706 . . . . 74.04 109.374 176.256 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.678 ' HB3' HE21 ' A' ' 36' ' ' GLN . 84.2 mm-40 -119.62 112.18 19.0 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.728 0.811 . . . . 75.13 109.706 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.549 ' HG2' HG12 ' A' ' 40' ' ' ILE . 3.6 tmtp? -92.06 107.4 19.18 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 106.747 -1.575 . . . . 74.01 106.747 173.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.678 HE21 ' HB3' ' A' ' 34' ' ' GLN . 83.6 mm-40 -119.55 101.58 8.03 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 108.522 -0.918 . . . . 75.5 108.522 -174.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.19 -93.72 0.52 Allowed Glycine 0 C--N 1.348 1.242 0 O-C-N 123.585 0.553 . . . . 40.33 112.488 -176.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -135.55 5.86 3.2 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.343 1.057 . . . . 64.03 109.26 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 69.3 m -118.67 116.16 26.01 Favored 'General case' 0 C--O 1.241 0.628 0 C-N-CA 124.69 1.196 . . . . 74.13 109.621 -177.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.549 HG12 ' HG2' ' A' ' 35' ' ' LYS . 35.0 mt -88.8 108.14 18.59 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-O 121.037 0.446 . . . . 75.01 110.119 178.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -86.17 95.22 9.5 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.403 1.081 . . . . 74.23 108.172 174.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 25.9 t -85.46 122.92 38.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 N-CA-C 109.13 -0.692 . . . . 61.33 109.13 178.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -87.24 121.21 29.39 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 108.007 -1.109 . . . . 75.13 108.007 170.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.8 mp -120.08 151.2 39.39 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-O 121.122 0.486 . . . . 73.12 109.917 179.289 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.507 ' HG3' ' HG3' ' A' ' 52' ' ' LYS . 39.3 tt0 -106.31 102.5 11.9 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 107.77 -1.196 . . . . 42.14 107.77 -179.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.499 HD12 ' HB3' ' A' ' 19' ' ' LEU . 8.8 tt -102.0 112.16 24.7 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.146 -1.057 . . . . 73.5 108.146 -174.558 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.4 ' HA ' ' O ' ' A' ' 51' ' ' LYS . 98.7 mtt180 -100.78 101.1 11.88 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.273 0.629 . . . . 72.32 110.181 -169.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 37.5 m -110.11 96.31 6.15 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 122.828 0.451 . . . . 71.31 110.314 179.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 51.8 m-20 60.14 39.12 19.86 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.699 1.2 . . . . 71.31 111.547 173.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.77 -6.52 60.53 Favored Glycine 0 C--N 1.347 1.192 0 CA-C-N 115.648 -0.705 . . . . 75.1 113.336 177.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.4 ' O ' ' HA ' ' A' ' 47' ' ' ARG . 27.4 mtpp -85.78 130.94 34.42 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.381 0.672 . . . . 62.32 110.315 177.508 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.509 ' HG2' HD21 ' A' ' 54' ' ' ASN . 39.8 ttmt -99.48 98.38 9.29 Favored 'General case' 0 C--O 1.245 0.838 0 N-CA-C 108.259 -1.015 . . . . 72.21 108.259 173.096 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -102.37 112.53 25.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.975 -1.011 . . . . 73.24 108.451 179.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.509 HD21 ' HG2' ' A' ' 52' ' ' LYS . 0.8 OUTLIER -92.0 115.2 27.86 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 109.058 -0.719 . . . . 63.1 109.058 -177.038 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -108.45 121.1 44.25 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.627 0.771 . . . . 55.11 109.359 179.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 35.0 m -90.93 100.83 13.62 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 108.265 -1.013 . . . . 73.23 108.265 169.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.448 HG13 HG12 ' A' ' 71' ' ' ILE . 47.3 t -93.66 103.41 14.66 Favored 'Isoleucine or valine' 0 C--O 1.241 0.656 0 N-CA-C 107.326 -1.361 . . . . 75.25 107.326 177.369 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -87.59 100.8 13.06 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.439 -0.8 . . . . 73.23 108.871 -176.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.446 HG22 HG22 ' A' ' 68' ' ' VAL . 25.5 t -104.45 116.1 47.62 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 124.113 0.965 . . . . 63.11 109.165 -177.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -100.78 143.53 30.83 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.246 1.018 . . . . 63.51 109.947 -175.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.7 tpp180 -71.36 134.19 46.52 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.163 0.585 . . . . 62.42 110.602 176.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -133.05 89.84 2.67 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 108.274 -1.01 . . . . 61.12 108.274 172.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 68.26 -111.26 3.89 Favored Glycine 0 C--N 1.35 1.323 0 CA-C-N 114.813 -1.085 . . . . 73.34 112.325 -177.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -92.26 -25.68 18.5 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.287 0.635 . . . . 74.11 111.089 178.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 22.9 p -99.12 175.76 5.79 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.917 0.887 . . . . 75.22 111.847 -175.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -123.57 158.52 31.22 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.522 1.129 . . . . 62.35 109.761 179.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 9.0 t -145.46 135.3 23.55 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.494 0.318 . . . . 72.2 110.725 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.573 HG21 ' HG3' ' A' ' 18' ' ' LYS . 91.3 t -77.86 115.47 19.89 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 N-CA-C 109.227 -0.657 . . . . 44.43 109.227 173.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -80.92 -41.89 22.24 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 123.24 0.616 . . . . 75.22 110.632 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -165.38 144.35 6.42 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 123.462 0.705 . . . . 73.35 110.261 175.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.448 HG12 HG13 ' A' ' 57' ' ' VAL . 41.8 mt -104.25 107.66 22.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 N-CA-C 108.027 -1.101 . . . . 63.03 108.027 168.322 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.0 m -107.76 108.39 19.58 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.204 0.602 . . . . 74.14 109.676 -178.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 -79.29 150.01 31.63 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 109.579 -0.526 . . . . 74.12 109.579 172.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.3 t -65.74 115.58 6.03 Favored 'General case' 0 CA--C 1.554 1.12 0 CA-C-N 115.656 -0.702 . . . . 63.13 109.951 172.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 5.3 p -88.77 103.52 13.95 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 CA-C-O 121.427 0.632 . . . . 73.22 109.828 -178.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -96.3 -33.25 6.32 Favored Glycine 0 C--N 1.348 1.213 0 N-CA-C 111.39 -0.684 . . . . 50.13 111.39 174.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 24.7 p -99.69 115.29 29.12 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.687 0.795 . . . . 60.21 110.198 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.2 pp -82.91 178.31 8.23 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-O 121.414 0.626 . . . . 71.21 111.04 174.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -136.0 -166.51 1.88 Allowed 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.109 0.964 . . . . 72.23 109.038 -179.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 82.2 m-70 -73.45 104.37 4.42 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 122.724 0.409 . . . . 50.33 110.338 -179.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 57.0 p-80 -87.65 124.79 33.91 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 107.916 -1.142 . . . . 75.34 107.916 169.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -76.45 -31.73 58.0 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.11 0.564 . . . . 75.35 111.056 -173.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -136.27 168.58 19.15 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.994 0.917 . . . . 73.24 110.638 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 30.0 m170 -92.43 42.24 1.1 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 124.215 1.006 . . . . 71.2 110.255 -178.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 29.3 m-70 . . . . . 0 C--O 1.249 1.029 0 C-N-CA 123.51 0.724 . . . . 71.22 109.05 -178.571 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.5 ptt? . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 109.69 -0.485 . . . . 72.22 109.69 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -63.2 -51.21 2.89 Favored 'Trans proline' 0 C--N 1.373 1.862 0 C-N-CA 122.029 1.819 . . . . 73.23 110.351 167.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 37.2 t -159.78 145.63 15.76 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 107.474 -1.306 . . . . 73.42 107.474 173.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.32 -32.22 72.2 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 123.027 0.531 . . . . 74.13 111.102 -174.292 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -76.02 -32.96 59.64 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.002 0.921 . . . . 74.25 110.487 178.082 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.479 ' HG3' HE21 ' A' ' 10' ' ' GLN . 13.2 tp10 -63.25 -32.29 73.66 Favored 'General case' 0 C--N 1.353 0.746 0 C-N-CA 124.111 0.964 . . . . 74.4 110.085 -179.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.555 ' O ' HG23 ' A' ' 11' ' ' VAL . 39.9 mm-40 -55.04 -45.91 75.26 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 124.258 0.974 . . . . 74.24 111.895 175.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -62.2 -36.57 82.33 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 122.898 0.479 . . . . 74.01 111.389 -178.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.405 ' HA ' ' HE3' ' A' ' 12' ' ' LYS . 43.5 mtp180 -63.73 -38.96 93.05 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 115.557 -0.747 . . . . 74.44 109.797 179.172 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.479 HE21 ' HG3' ' A' ' 6' ' ' GLU . 58.0 mt-30 -66.59 -40.93 89.13 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 114.753 -1.112 . . . . 73.12 110.875 176.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 7' ' ' GLU . 63.0 t -61.05 -44.78 98.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 123.434 0.694 . . . . 71.54 111.9 -175.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.405 ' HE3' ' HA ' ' A' ' 9' ' ' ARG . 10.1 mtmp? -60.92 -32.69 72.17 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 123.732 0.645 . . . . 72.45 110.724 179.65 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.511 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.9 tt0 -71.68 -53.78 12.45 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 115.361 -0.836 . . . . 70.33 110.323 176.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.402 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 98.5 t -53.91 -36.27 30.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 C-N-CA 123.598 0.759 . . . . 72.34 110.759 179.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.466 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -66.85 -50.95 60.9 Favored 'General case' 0 C--O 1.247 0.924 0 CA-C-N 114.795 -1.093 . . . . 43.25 111.454 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.45 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 20.5 ptmt -69.46 -33.08 72.38 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 116.18 -0.464 . . . . 73.23 111.925 -175.133 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.511 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 19.3 mm-40 -61.86 -43.0 99.72 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 123.691 0.619 . . . . 72.45 110.122 -179.114 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.432 ' HG3' HG21 ' A' ' 68' ' ' VAL . 14.9 mmmm -73.88 -22.43 59.73 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 115.603 -0.726 . . . . 62.15 111.143 -178.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 57.9 mt -73.9 -36.22 64.73 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 122.852 0.461 . . . . 65.34 111.541 169.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 83.6 mt -66.12 -32.15 73.44 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.627 0.771 . . . . 63.45 110.77 178.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -57.19 -41.31 79.08 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.918 0.887 . . . . 71.33 110.962 174.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.496 HE22 HG21 ' A' ' 71' ' ' ILE . 46.9 mt-30 -80.75 -51.72 8.34 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.488 -0.778 . . . . 73.2 110.824 -177.003 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 27.1 t -131.11 89.4 42.14 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 123.277 0.631 . . . . 64.13 109.927 -175.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -80.06 -1.93 11.73 Favored 'Trans proline' 0 C--N 1.375 1.965 0 C-N-CA 122.989 2.459 . . . . 73.41 112.592 174.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -86.56 6.55 30.19 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.964 0.906 . . . . 75.31 111.832 -178.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 21.5 p -143.72 141.98 30.73 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.514 0.726 . . . . 65.22 110.644 -171.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -86.72 136.63 32.94 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 108.342 -0.985 . . . . 72.53 108.342 174.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.508 HG22 HD12 ' A' ' 46' ' ' LEU . 40.7 t -98.61 117.18 43.21 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 C-N-CA 123.114 0.566 . . . . 73.45 110.236 -174.069 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 54.4 tp60 -91.71 147.57 22.9 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.806 1.243 . . . . 75.21 109.168 175.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 79.9 t -87.92 121.2 38.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 N-CA-C 108.343 -0.984 . . . . 61.54 108.343 170.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.3 tpt180 -94.72 -59.62 1.88 Allowed 'General case' 0 N--CA 1.477 0.88 0 O-C-N 123.295 0.372 . . . . 74.31 110.242 -178.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 50.3 mtt180 -148.53 165.2 31.93 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 124.321 1.048 . . . . 73.43 110.166 -179.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 82.0 t -137.16 132.78 46.87 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 C-N-CA 124.346 1.059 . . . . 73.24 109.127 178.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.414 ' HB2' ' HB2' ' A' ' 41' ' ' ARG . 69.2 mm-40 -125.46 108.57 11.76 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.332 1.053 . . . . 73.5 108.814 -177.213 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.5 tmtt? -92.87 106.92 18.81 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 108.042 -1.096 . . . . 70.2 108.042 -176.636 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.2 mm-40 -120.51 89.01 3.04 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.443 0.697 . . . . 73.33 109.791 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.6 -98.58 0.41 Allowed Glycine 0 C--N 1.35 1.339 0 CA-C-N 115.598 -0.728 . . . . 72.33 112.501 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.455 HD22 ' HB3' ' A' ' 61' ' ' ARG . 16.7 m120 -105.87 -26.16 11.84 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.738 0.815 . . . . 70.12 110.349 175.125 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 25.1 m -87.77 98.68 11.59 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.406 0.683 . . . . 74.31 110.475 -177.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.523 HD12 HG21 ' A' ' 11' ' ' VAL . 40.1 mt -90.12 108.47 19.51 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 CA-C-N 116.085 -0.507 . . . . 72.35 109.867 171.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.584 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 91.6 mtt180 -84.12 105.8 15.27 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.402 1.081 . . . . 65.04 109.388 174.44 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.1 t -95.19 118.94 42.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 N-CA-C 108.721 -0.844 . . . . 54.24 108.721 174.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -83.74 115.24 22.11 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 107.992 -1.114 . . . . 75.13 107.992 168.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.445 HD11 ' HB1' ' A' ' 15' ' ' ALA . 2.7 mp -108.71 170.83 7.78 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.887 -0.783 . . . . 53.5 108.887 174.355 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -135.75 107.68 7.11 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.862 -0.792 . . . . 74.52 108.862 -168.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.508 HD12 HG22 ' A' ' 28' ' ' VAL . 9.2 tt -127.71 138.15 52.69 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.831 1.252 . . . . 75.44 108.697 -168.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 48.9 mtm105 -102.42 99.83 9.92 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 122.828 0.451 . . . . 72.04 110.923 -175.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 1.9 m -98.5 116.89 31.69 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.795 0.838 . . . . 51.45 110.225 -179.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 61.93 30.42 18.08 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 124.324 1.05 . . . . 72.22 112.498 174.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 84.45 5.91 86.47 Favored Glycine 0 C--N 1.343 0.964 0 CA-C-N 116.131 -0.486 . . . . 54.22 113.092 -178.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.532 ' HA ' ' HE2' ' A' ' 51' ' ' LYS . 9.9 mmpt? -110.97 127.16 55.41 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.629 0.772 . . . . 52.14 109.813 175.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -79.61 113.57 17.86 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 108.209 -1.034 . . . . 53.44 108.209 176.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -120.51 127.82 52.54 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.773 1.229 . . . . 74.22 109.091 178.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -88.58 130.02 35.35 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 109.163 -0.681 . . . . 73.33 109.163 175.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -114.22 118.71 34.74 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 109.279 -0.637 . . . . 72.45 109.279 178.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 38.4 m -86.16 100.7 12.4 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 108.458 -0.942 . . . . 75.42 108.458 172.367 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.466 HG11 ' HA ' ' A' ' 15' ' ' ALA . 60.1 t -92.91 106.52 18.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 N-CA-C 108.411 -0.959 . . . . 72.45 108.411 178.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.584 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 33.1 mt-10 -77.31 107.6 9.83 Favored 'General case' 0 C--O 1.222 -0.353 0 N-CA-C 108.056 -1.09 . . . . 63.51 108.056 178.213 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.521 HG22 HG22 ' A' ' 68' ' ' VAL . 38.8 t -112.14 124.38 68.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 N-CA-C 109.006 -0.739 . . . . 72.42 109.006 176.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -112.92 147.51 36.92 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.499 0.719 . . . . 72.24 110.128 -177.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.455 ' HB3' HD22 ' A' ' 38' ' ' ASN . 9.8 tpt180 -74.96 106.78 6.63 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.372 -0.831 . . . . 75.23 110.357 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 22.7 tp60 -91.22 79.12 5.73 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 108.388 -0.968 . . . . 75.0 108.388 174.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 73.24 -100.53 1.05 Allowed Glycine 0 C--N 1.348 1.215 0 CA-C-N 114.986 -1.006 . . . . 74.33 112.366 -179.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -95.0 -32.2 13.26 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.142 0.977 . . . . 52.12 110.265 176.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.8 p -96.08 176.46 6.08 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.687 0.795 . . . . 63.11 111.358 -175.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . 0.427 ' HZ2' ' HB3' ' A' ' 7' ' ' GLU . 96.3 m95 -119.08 149.07 42.3 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.844 1.258 . . . . 72.5 109.934 179.21 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 14.9 t -147.92 140.19 24.31 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.276 0.63 . . . . 65.32 110.281 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.521 HG22 HG22 ' A' ' 59' ' ' VAL . 76.4 t -80.78 114.15 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 123.047 0.539 . . . . 72.24 110.815 -177.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -65.41 -54.75 24.18 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.743 1.217 . . . . 74.41 110.85 175.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 2.3 tpm_? -163.36 132.18 3.92 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.608 -0.723 . . . . 74.23 110.012 -178.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.496 HG21 HE22 ' A' ' 22' ' ' GLN . 63.5 mt -87.76 107.4 17.29 Favored 'Isoleucine or valine' 0 C--O 1.24 0.568 0 N-CA-C 107.828 -1.175 . . . . 64.54 107.828 167.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 22.2 m -98.48 115.5 28.68 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.112 -0.949 . . . . 74.43 108.773 -178.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 11.8 ttm180 -69.49 149.31 48.4 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 108.883 -0.784 . . . . 75.31 108.883 171.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 8.1 t -59.94 152.82 22.65 Favored 'General case' 0 C--O 1.245 0.867 0 C-N-CA 123.0 0.52 . . . . 73.44 110.307 173.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 7.6 p -61.85 123.9 15.4 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 N-CA-C 109.441 -0.577 . . . . 75.43 109.441 176.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 165.34 -92.38 0.11 Allowed Glycine 0 C--N 1.333 0.385 0 N-CA-C 110.202 -1.159 . . . . 72.23 110.202 -175.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 36.6 t -81.38 80.07 7.86 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 108.976 -0.75 . . . . 64.23 108.976 176.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 68.0 tp -90.43 136.18 33.22 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.387 -0.824 . . . . 65.01 109.444 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -65.75 129.93 41.49 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 123.926 0.766 . . . . 71.32 109.69 174.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 11.5 p80 -82.53 61.69 5.8 Favored 'General case' 0 N--CA 1.482 1.125 0 CA-C-O 122.167 0.984 . . . . 73.44 110.343 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 26.3 p80 -67.35 134.12 50.91 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 114.616 -1.175 . . . . 53.11 111.279 -173.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 33.9 t60 -129.17 117.31 20.58 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.909 0.884 . . . . 72.31 109.032 178.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 50.7 m-70 -131.19 134.63 46.68 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 108.513 -0.921 . . . . 63.14 108.513 178.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 8.9 p80 -61.1 140.75 57.8 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.6 0.76 . . . . 72.23 111.558 -173.523 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 10.4 p-80 . . . . . 0 CA--C 1.552 1.055 0 CA-C-O 118.916 -0.564 . . . . 71.44 109.891 173.296 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.8 mmt . . . . . 0 N--CA 1.484 1.273 0 N-CA-C 110.233 -0.284 . . . . 71.51 110.233 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -76.39 72.6 5.41 Favored 'Trans proline' 0 C--N 1.37 1.708 0 C-N-CA 122.15 1.9 . . . . 54.31 110.324 175.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.1 t -62.38 -28.0 69.47 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.968 0.907 . . . . 74.25 112.966 -168.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -66.65 -49.13 67.23 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.938 0.495 . . . . 73.12 110.13 172.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -75.63 -19.29 59.31 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.847 1.259 . . . . 50.43 111.251 -179.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -64.18 -14.31 54.37 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.372 1.069 . . . . 64.4 111.822 -174.232 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -46.28 -53.23 11.11 Favored 'General case' 0 C--O 1.209 -1.037 0 C-N-CA 123.764 0.825 . . . . 74.52 109.948 165.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.658 ' HG3' HG11 ' A' ' 33' ' ' VAL . 1.1 mptm? -58.57 -45.34 89.2 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.312 1.045 . . . . 75.14 111.208 179.478 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 28.3 mmm180 -55.97 -42.24 75.98 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.857 0.863 . . . . 74.34 110.881 -177.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -78.57 -55.13 5.44 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 114.773 -1.103 . . . . 52.34 111.34 -178.302 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.426 HG12 HG21 ' A' ' 42' ' ' VAL . 73.9 t -65.81 -37.58 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 124.842 1.257 . . . . 73.24 113.218 -166.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.473 ' HD2' HG21 ' A' ' 30' ' ' VAL . 22.3 mtmm -64.01 -38.12 89.92 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-N 118.163 0.438 . . . . 75.41 109.903 178.463 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.537 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.5 tt0 -69.05 -45.53 70.18 Favored 'General case' 0 C--N 1.352 0.679 0 CA-C-N 115.349 -0.841 . . . . 64.44 110.494 178.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.484 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 92.8 t -60.19 -41.51 86.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 123.228 0.611 . . . . 73.44 109.99 177.205 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.76 -39.08 76.92 Favored 'General case' 0 C--O 1.244 0.769 0 C-N-CA 124.213 1.005 . . . . 75.51 111.927 -176.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.454 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 21.6 ptmt -71.87 -30.89 65.9 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 119.297 -0.383 . . . . 43.54 110.566 -179.128 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 24.4 mm-40 -61.91 -41.77 98.31 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 123.609 0.568 . . . . 74.44 110.4 174.232 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.648 ' HB3' HD11 ' A' ' 71' ' ' ILE . 2.1 mmmp? -61.41 -36.54 80.6 Favored 'General case' 0 CA--C 1.55 0.948 0 O-C-N 124.048 0.842 . . . . 73.34 110.507 178.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.593 ' HB3' HD12 ' A' ' 46' ' ' LEU . 52.0 mt -76.07 -31.91 59.0 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.788 0.835 . . . . 73.33 112.436 177.276 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 93.3 mt -73.11 -25.44 60.86 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.987 0.515 . . . . 62.44 110.902 178.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 49.5 mt-10 -65.11 -42.71 93.71 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-O 121.293 0.568 . . . . 73.1 110.149 171.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -71.37 -36.3 71.4 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 115.044 -0.98 . . . . 71.53 111.238 178.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.2 t -148.88 89.75 4.91 Favored Pre-proline 0 CA--C 1.544 0.716 0 CA-C-N 115.836 -0.62 . . . . 71.24 109.688 -175.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -70.37 -17.46 34.78 Favored 'Trans proline' 0 C--N 1.377 2.034 0 C-N-CA 122.828 2.352 . . . . 61.23 111.609 172.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -79.59 -10.73 59.85 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.338 1.055 . . . . 61.43 112.099 -176.315 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 68.7 p -104.8 157.0 17.5 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.514 0.726 . . . . 72.1 111.672 -178.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.504 ' HA ' ' HE3' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -102.86 124.18 47.91 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 108.353 -0.98 . . . . 62.42 108.353 164.626 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.402 HG11 HD12 ' A' ' 19' ' ' LEU . 49.4 t -101.4 114.22 39.96 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 123.796 0.838 . . . . 72.54 109.958 -178.363 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -93.53 165.11 12.91 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 124.322 1.049 . . . . 74.31 108.693 171.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.473 HG21 ' HD2' ' A' ' 12' ' ' LYS . 4.0 p -81.92 132.5 31.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 N-CA-C 109.0 -0.741 . . . . 60.21 109.0 165.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 -100.93 -44.21 5.82 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.362 0.665 . . . . 72.2 109.933 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -167.67 151.02 6.11 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 108.024 -1.102 . . . . 64.22 108.024 -175.039 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.658 HG11 ' HG3' ' A' ' 8' ' ' LYS . 65.8 t -129.62 130.77 67.11 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 123.487 0.715 . . . . 60.33 109.297 176.163 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -121.88 108.11 13.07 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.06 0.944 . . . . 70.11 109.801 177.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -92.17 109.68 21.05 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 108.395 -0.965 . . . . 74.34 108.395 171.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -122.52 90.13 3.24 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.768 0.827 . . . . 64.44 109.598 -178.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.26 -85.38 0.1 Allowed Glycine 0 C--N 1.348 1.2 0 CA-C-N 115.78 -0.645 . . . . 54.53 114.218 173.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -118.2 4.44 11.95 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 124.303 1.041 . . . . 64.0 111.869 -176.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 47.5 m -142.18 119.47 11.51 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.815 0.446 . . . . 62.15 111.043 -174.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.405 HD12 HG21 ' A' ' 11' ' ' VAL . 24.5 mt -94.75 108.12 20.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 123.171 0.588 . . . . 53.14 109.758 171.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 11.9 mtm180 -90.12 99.98 12.89 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 107.365 -1.346 . . . . 73.25 107.365 174.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.439 HG13 HG22 ' A' ' 33' ' ' VAL . 40.5 t -91.07 116.53 32.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 N-CA-C 108.911 -0.774 . . . . 75.35 108.911 178.228 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -79.15 127.04 31.52 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 107.652 -1.24 . . . . 74.31 107.652 167.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.8 mp -124.22 154.42 40.18 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 109.386 -0.598 . . . . 73.4 109.386 177.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -107.27 104.5 14.13 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 108.932 -0.766 . . . . 74.43 108.932 -177.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.593 HD12 ' HB3' ' A' ' 19' ' ' LEU . 9.5 tt -100.76 126.53 47.32 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 108.244 -1.021 . . . . 64.21 108.244 -178.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -125.58 101.57 6.97 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 122.884 0.473 . . . . 74.14 110.949 -173.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 16.0 m -110.44 119.05 37.93 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.15 0.58 . . . . 61.14 109.936 -177.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 61.75 24.05 14.24 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.482 1.113 . . . . 70.0 111.831 172.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.76 -14.7 61.57 Favored Glycine 0 C--N 1.353 1.5 0 CA-C-O 119.319 -0.712 . . . . 62.25 113.496 178.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.24 148.15 29.62 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 118.239 1.019 . . . . 51.11 108.621 173.336 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -118.15 134.72 54.74 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.616 0.766 . . . . 72.52 109.313 176.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -145.29 127.87 16.1 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 108.597 -0.89 . . . . 62.04 108.597 174.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.467 HD22 ' N ' ' A' ' 54' ' ' ASN . 0.7 OUTLIER -86.85 143.04 27.63 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.975 0.91 . . . . 63.51 109.3 -178.529 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -132.07 120.25 22.11 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.018 0.527 . . . . 72.43 110.007 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 91.0 m -84.98 100.29 11.56 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 108.825 -0.805 . . . . 62.11 108.825 170.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 71.2 t -93.02 103.86 15.12 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 N-CA-C 107.047 -1.464 . . . . 71.24 107.047 174.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.434 ' HB2' ' HB2' ' A' ' 69' ' ' LYS . 41.1 mt-10 -79.41 114.58 18.46 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 114.917 -1.038 . . . . 75.34 108.583 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.4 HG22 HG22 ' A' ' 68' ' ' VAL . 44.5 t -115.73 122.2 68.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 124.047 0.939 . . . . 62.44 108.61 177.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.474 ' HB2' ' HD3' ' A' ' 69' ' ' LYS . 35.9 tt0 -100.59 144.68 29.28 Favored 'General case' 0 C--O 1.241 0.653 0 C-N-CA 124.426 1.09 . . . . 75.12 109.827 -173.399 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 26.0 tpt180 -80.73 105.5 12.01 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.388 0.675 . . . . 74.53 109.447 174.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -108.12 89.47 3.01 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.375 1.07 . . . . 73.41 108.208 179.079 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 71.0 -107.51 2.19 Favored Glycine 0 CA--C 1.529 0.965 0 N-CA-C 111.693 -0.563 . . . . 71.44 111.693 -174.302 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -113.6 -3.57 13.6 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.882 0.873 . . . . 73.43 109.99 174.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 32.8 p -99.02 172.55 7.33 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.329 0.585 . . . . 74.3 111.096 176.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -119.49 140.72 50.02 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.876 1.27 . . . . 71.04 109.227 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 9.0 t -140.28 124.32 17.54 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 121.196 0.522 . . . . 73.32 110.453 -178.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.4 HG22 HG22 ' A' ' 59' ' ' VAL . 90.0 t -75.28 114.36 15.24 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 C-N-CA 123.287 0.635 . . . . 65.1 110.17 -177.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.474 ' HD3' ' HB2' ' A' ' 60' ' ' GLU . 32.1 mmmt -64.93 -50.4 66.61 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.626 1.171 . . . . 52.21 110.43 176.208 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -170.37 165.1 8.8 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 124.508 1.13 . . . . 72.45 110.035 175.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.648 HD11 ' HB3' ' A' ' 18' ' ' LYS . 75.1 mt -101.44 107.22 20.99 Favored 'Isoleucine or valine' 0 C--O 1.24 0.593 0 N-CA-C 107.491 -1.299 . . . . 70.42 107.491 166.038 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 12.3 m -92.87 114.58 27.18 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 109.299 -0.63 . . . . 75.11 109.299 -178.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 -68.05 141.47 56.16 Favored 'General case' 0 C--O 1.245 0.816 0 N-CA-C 109.037 -0.727 . . . . 72.45 109.037 169.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.5 t -64.38 137.84 58.11 Favored 'General case' 0 C--O 1.245 0.845 0 N-CA-C 109.112 -0.699 . . . . 71.21 109.112 173.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.484 HG23 ' HB3' ' A' ' 78' ' ' LEU . 14.2 p -121.3 134.33 65.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 108.462 -0.94 . . . . 51.34 108.462 -176.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -163.36 100.86 0.18 Allowed Glycine 0 N--CA 1.466 0.646 0 N-CA-C 109.619 -1.392 . . . . 63.13 109.619 -178.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.1 m 61.16 22.34 12.66 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.288 1.035 . . . . 74.24 111.244 -171.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.484 ' HB3' HG23 ' A' ' 75' ' ' VAL . 6.5 tt -109.14 131.09 55.4 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 107.74 -1.207 . . . . 74.22 107.74 -176.398 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -73.2 93.86 1.9 Allowed 'General case' 0 C--O 1.24 0.571 0 O-C-N 123.651 0.594 . . . . 52.01 109.948 179.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.417 ' ND1' HG21 ' A' ' 75' ' ' VAL . 21.1 p-80 -74.92 83.38 2.2 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 107.717 -1.216 . . . . 63.42 107.717 170.048 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 30.0 t60 -63.79 119.53 10.15 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 114.233 -1.349 . . . . 54.23 110.285 -170.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 57.4 m80 -69.27 103.09 1.86 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.596 1.158 . . . . 74.11 111.179 -173.116 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 20.5 t-80 -118.9 123.98 45.98 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.061 -1.089 . . . . 74.32 108.061 174.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -67.58 137.04 55.39 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.204 0.602 . . . . 64.0 110.956 -173.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 9.7 p80 . . . . . 0 N--CA 1.478 0.943 0 C-N-CA 124.738 1.215 . . . . 74.13 109.128 177.772 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 46.0 ttm . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 109.99 -0.374 . . . . 75.33 109.99 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -84.35 115.26 1.91 Allowed 'Trans proline' 0 C--N 1.375 1.945 0 C-N-CA 122.472 2.115 . . . . 74.25 110.648 172.087 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 69.7 p -102.77 9.4 39.08 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.309 0.644 . . . . 55.42 111.593 -178.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -61.48 -52.67 63.55 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.3 1.04 . . . . 65.33 111.659 -174.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.456 ' HA ' ' HD3' ' A' ' 8' ' ' LYS . 17.0 tp10 -70.11 -28.42 65.38 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-N 116.128 -0.487 . . . . 63.23 110.587 -179.421 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -67.59 -28.76 68.04 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.252 1.021 . . . . 73.23 111.138 178.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -56.69 -44.08 81.13 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.333 0.653 . . . . 54.12 110.309 174.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.456 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 0.1 OUTLIER -64.67 -45.47 86.58 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 124.059 0.849 . . . . 75.03 108.977 177.592 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 21.7 mtm180 -58.25 -40.02 80.68 Favored 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 123.866 0.866 . . . . 75.54 111.649 -178.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -67.57 -55.12 14.66 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.128 0.971 . . . . 74.01 110.314 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.602 HG21 HD12 ' A' ' 40' ' ' ILE . 72.4 t -64.97 -36.31 77.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 123.811 0.844 . . . . 74.4 112.436 -172.504 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 8' ' ' LYS . 10.3 mtmp? -65.4 -42.63 92.39 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.658 0.383 . . . . 72.11 110.26 176.362 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.501 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.2 tt0 -66.09 -49.29 68.1 Favored 'General case' 0 C--N 1.352 0.691 0 O-C-N 123.866 0.729 . . . . 64.11 110.217 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.484 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 84.6 t -57.87 -46.23 87.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 123.232 0.613 . . . . 74.43 109.862 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.449 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -60.25 -51.61 68.84 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.77 0.828 . . . . 52.03 112.295 -178.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -63.4 -39.5 94.67 Favored 'General case' 0 C--N 1.351 0.633 0 O-C-N 123.924 0.765 . . . . 73.32 110.406 -178.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 33.4 mm-40 -66.59 -40.66 89.0 Favored 'General case' 0 C--N 1.353 0.748 0 O-C-N 123.409 0.443 . . . . 73.53 110.975 178.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.484 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 73.4 mmtt -64.17 -35.31 80.38 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.484 0.714 . . . . 64.43 110.95 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.614 ' HB3' HD12 ' A' ' 46' ' ' LEU . 61.5 mt -75.5 -30.44 59.85 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.627 -0.715 . . . . 75.11 111.545 175.686 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.0 mt -73.29 -28.4 62.09 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.523 0.729 . . . . 72.5 110.978 174.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 24.4 mm-40 -59.24 -36.35 75.29 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 123.29 0.636 . . . . 75.32 110.172 174.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -91.83 -30.4 16.22 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 114.444 -1.253 . . . . 61.44 111.199 -175.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.2 t -148.81 88.33 5.24 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 122.82 0.448 . . . . 52.14 110.685 -175.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -76.04 -20.91 14.46 Favored 'Trans proline' 0 C--N 1.383 2.359 0 C-N-CA 123.155 2.57 . . . . 75.42 113.367 178.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -78.31 -13.18 59.96 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.346 0.658 . . . . 74.11 111.733 -176.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 54.0 p -105.87 135.5 47.18 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.577 0.751 . . . . 33.01 110.487 177.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -75.06 126.61 31.38 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 108.708 -0.849 . . . . 55.22 108.708 167.414 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 58.6 t -100.85 112.91 35.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 109.421 -0.585 . . . . 62.04 109.421 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.512 ' HB2' ' HB3' ' A' ' 45' ' ' GLU . 15.8 mm100 -100.0 123.76 44.61 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.909 1.284 . . . . 74.32 109.397 -178.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 p -64.88 115.78 3.52 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 N-CA-C 109.121 -0.696 . . . . 51.31 109.121 173.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 -96.53 -42.14 8.22 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.716 -0.675 . . . . 73.05 110.25 -171.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.473 ' HB3' ' HB2' ' A' ' 43' ' ' GLU . 60.6 ttt180 -154.71 143.79 21.05 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.463 0.705 . . . . 72.11 110.181 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.8 t -114.63 110.69 32.97 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 N-CA-C 107.982 -1.118 . . . . 71.23 107.982 173.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 23.7 tp60 -125.7 117.07 22.69 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 118.162 0.437 . . . . 61.23 111.308 -174.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.6 tppp? -78.23 134.66 37.55 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.905 0.882 . . . . 44.03 110.59 178.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.8 mm-40 -128.43 84.05 2.21 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.365 1.066 . . . . 73.53 108.331 170.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.43 -93.18 0.7 Allowed Glycine 0 C--N 1.35 1.344 0 CA-C-N 115.83 -0.623 . . . . 74.24 111.618 -175.312 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.498 ' HB3' ' HB3' ' A' ' 61' ' ' ARG . 3.9 m-20 -119.27 -13.07 9.34 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 123.557 0.743 . . . . 65.23 110.299 173.3 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.617 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 21.2 m -91.84 99.25 12.15 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 123.685 0.794 . . . . 72.04 110.177 -179.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.602 HD12 HG21 ' A' ' 11' ' ' VAL . 37.9 mt -76.55 107.77 8.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 N-CA-C 108.988 -0.745 . . . . 74.3 108.988 175.071 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.474 HH21 HG21 ' A' ' 56' ' ' THR . 54.0 mtp180 -83.68 95.4 8.37 Favored 'General case' 0 C--O 1.24 0.603 0 N-CA-C 107.508 -1.293 . . . . 73.22 107.508 169.133 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.419 HG21 ' HB2' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -85.02 123.31 39.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 N-CA-C 108.685 -0.857 . . . . 71.11 108.685 173.948 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.473 ' HB2' ' HB3' ' A' ' 32' ' ' ARG . 45.0 mt-10 -89.33 130.51 35.7 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 123.943 0.897 . . . . 63.23 108.748 170.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.2 mp -130.2 168.68 16.44 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.214 0.53 . . . . 72.24 110.108 179.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.512 ' HB3' ' HB2' ' A' ' 29' ' ' GLN . 31.1 tt0 -118.24 119.33 34.36 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 125.455 1.502 . . . . 72.31 108.508 -174.177 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.614 HD12 ' HB3' ' A' ' 19' ' ' LEU . 8.1 tt -133.36 129.85 38.01 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.077 -1.453 . . . . 75.14 107.077 -176.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 50.8 mtp180 -100.28 102.76 14.11 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.147 0.579 . . . . 73.23 109.882 -175.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.1 m -101.09 122.64 43.94 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 108.589 -0.893 . . . . 64.23 108.589 179.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 60.74 24.87 14.72 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 124.075 0.95 . . . . 73.44 111.789 174.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 96.17 -21.4 45.48 Favored Glycine 0 C--N 1.35 1.336 0 CA-C-N 115.902 -0.59 . . . . 44.02 113.049 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -84.56 157.24 21.3 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.044 0.938 . . . . 65.25 110.063 -179.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -111.97 105.95 14.51 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.281 0.632 . . . . 61.5 111.172 -173.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.551 ' HG2' ' HD2' ' A' ' 73' ' ' ARG . 13.2 mp0 -105.11 143.37 33.38 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.055 0.942 . . . . 62.32 110.299 179.7 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -93.96 131.63 39.22 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 108.949 -0.76 . . . . 74.42 108.949 173.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.534 ' CE2' ' HB3' ' A' ' 46' ' ' LEU . 20.9 m-85 -120.44 121.45 38.55 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.535 0.734 . . . . 74.41 109.726 178.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.474 HG21 HH21 ' A' ' 41' ' ' ARG . 25.1 m -87.63 103.88 15.99 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.757 0.823 . . . . 33.51 109.455 173.56 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.449 HG11 ' HA ' ' A' ' 15' ' ' ALA . 48.9 t -93.74 105.26 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 N-CA-C 107.55 -1.278 . . . . 54.45 107.55 172.621 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -88.49 100.11 12.81 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 108.407 -0.961 . . . . 64.03 108.407 -177.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.573 HG22 HG22 ' A' ' 68' ' ' VAL . 29.1 t -104.03 118.92 51.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 123.792 0.837 . . . . 63.52 108.948 -178.63 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.617 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 31.0 tt0 -101.07 146.47 27.4 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.089 0.956 . . . . 64.3 110.114 -177.432 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.498 ' HB3' ' HB3' ' A' ' 38' ' ' ASN . 7.7 tpp180 -74.31 142.16 45.21 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 116.158 -0.474 . . . . 71.11 110.106 173.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -142.61 83.3 1.81 Allowed 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 108.123 -1.066 . . . . 71.21 108.123 175.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.21 -104.07 1.2 Allowed Glycine 0 C--N 1.345 1.08 0 CA-C-N 115.33 -0.85 . . . . 62.44 112.032 -176.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -101.84 -19.18 15.41 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.123 0.569 . . . . 62.14 111.091 179.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 14.6 t -100.25 172.9 6.88 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 122.869 0.468 . . . . 74.1 111.319 -176.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -123.08 120.96 34.83 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.605 1.162 . . . . 72.43 109.208 179.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.9 t -111.97 120.5 42.12 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 123.918 0.887 . . . . 72.41 110.484 179.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.573 HG22 HG22 ' A' ' 59' ' ' VAL . 58.9 t -74.81 120.18 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 N-CA-C 109.68 -0.489 . . . . 70.15 109.68 179.092 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.412 ' HA ' ' HE2' ' A' ' 69' ' ' LYS . 11.5 mmpt? -76.59 -55.59 5.38 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.394 1.077 . . . . 71.21 110.923 -179.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 23.2 ttt85 -163.68 125.73 2.46 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.687 -0.688 . . . . 75.3 110.412 -172.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.456 HD11 ' HB3' ' A' ' 18' ' ' LYS . 57.1 mt -93.35 131.05 41.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 N-CA-C 107.917 -1.142 . . . . 73.04 107.917 167.5 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 84.7 m -137.91 125.48 22.14 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 123.516 0.726 . . . . 61.24 109.689 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.551 ' HD2' ' HG2' ' A' ' 53' ' ' GLU . 36.7 ttp85 -75.37 144.65 42.19 Favored 'General case' 0 C--O 1.242 0.701 0 N-CA-C 108.43 -0.952 . . . . 72.14 108.43 170.126 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.3 t -57.78 148.08 26.16 Favored 'General case' 0 C--O 1.249 1.073 0 C-N-CA 123.478 0.711 . . . . 73.24 109.55 172.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 77.4 t -63.57 98.03 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.355 0.837 0 CA-C-O 121.662 0.744 . . . . 63.11 109.213 -178.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -119.44 34.28 4.33 Favored Glycine 0 C--N 1.339 0.696 0 CA-C-N 114.271 -1.331 . . . . 45.44 109.778 175.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.1 t -147.64 -167.64 2.85 Favored 'General case' 0 C--O 1.243 0.747 0 C-N-CA 125.293 1.437 . . . . 75.42 107.431 -175.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.435 HD23 ' H ' ' A' ' 78' ' ' LEU . 2.5 pt? -65.19 145.85 55.72 Favored 'General case' 0 C--O 1.249 1.065 0 N-CA-C 109.647 -0.501 . . . . 73.4 109.647 171.362 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -75.92 86.02 2.86 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.298 -0.865 . . . . 75.42 109.091 178.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 8.7 p-80 -56.99 90.28 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.892 1.677 . . . . 63.35 112.804 -174.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 35.0 t-80 -86.7 121.4 29.16 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 109.309 -0.626 . . . . 74.21 109.309 173.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 7.3 p80 -119.75 162.13 19.57 Favored 'General case' 0 C--O 1.244 0.772 0 C-N-CA 123.845 0.858 . . . . 74.13 108.691 176.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -78.37 153.24 31.79 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 120.875 0.369 . . . . 70.34 111.329 -177.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 47.5 t-80 -109.92 94.28 4.94 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 108.045 -1.094 . . . . 62.44 108.045 173.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 65.0 t60 . . . . . 0 C--O 1.25 1.095 0 N-CA-C 108.981 -0.748 . . . . 74.35 108.981 179.313 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.0 mmm . . . . . 0 CA--C 1.549 0.92 0 N-CA-C 109.137 -0.69 . . . . 63.34 109.137 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -73.64 116.55 4.72 Favored 'Trans proline' 0 C--N 1.378 2.125 0 C-N-CA 122.514 2.142 . . . . 63.22 111.292 -179.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 89.4 p -74.46 143.6 44.59 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 108.856 -0.794 . . . . 75.13 108.856 176.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.457 ' O ' ' HD3' ' A' ' 8' ' ' LYS . 28.7 tt0 -64.56 -30.27 71.3 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 110.507 -0.182 . . . . 72.52 110.507 -178.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.424 ' HA ' ' HE2' ' A' ' 8' ' ' LYS . 44.9 tt0 -65.56 -36.62 84.32 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 122.964 0.505 . . . . 73.21 111.077 176.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -62.45 -35.11 78.27 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.411 0.684 . . . . 72.23 109.912 171.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.548 ' O ' HG23 ' A' ' 11' ' ' VAL . 29.6 mm-40 -67.48 -49.47 63.4 Favored 'General case' 0 C--N 1.35 0.599 0 CA-C-O 118.604 -0.712 . . . . 75.3 110.413 -179.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.68 ' HG3' HD13 ' A' ' 40' ' ' ILE . 4.0 mppt? -57.16 -37.33 71.92 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-N 118.228 0.467 . . . . 53.33 111.321 175.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.585 ' HA ' ' HE2' ' A' ' 12' ' ' LYS . 77.0 ttt180 -59.51 -43.53 93.37 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 123.642 0.589 . . . . 75.05 110.772 177.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.484 ' O ' HG23 ' A' ' 14' ' ' VAL . 48.8 mt-30 -64.76 -43.67 92.57 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 115.122 -0.945 . . . . 72.23 110.53 175.203 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.548 HG23 ' O ' ' A' ' 7' ' ' GLU . 74.7 t -62.81 -39.07 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 C-N-CA 124.499 1.12 . . . . 65.51 111.961 -176.27 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.585 ' HE2' ' HA ' ' A' ' 9' ' ' ARG . 49.7 mtmt -64.55 -36.16 83.31 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.291 0.637 . . . . 63.4 110.57 178.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.521 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 9.6 tt0 -67.09 -49.11 66.1 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 124.067 0.854 . . . . 70.45 109.889 175.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 10' ' ' GLN . 61.3 t -59.06 -32.42 47.81 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 123.387 0.675 . . . . 74.11 110.571 178.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.466 ' HA ' HG11 ' A' ' 57' ' ' VAL . . . -73.15 -49.36 28.68 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.254 1.021 . . . . 65.32 111.975 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -68.95 -36.64 78.15 Favored 'General case' 0 N--CA 1.479 1.008 0 O-C-N 123.753 0.658 . . . . 75.43 111.416 -173.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.521 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 16.0 mm-40 -64.65 -39.76 94.27 Favored 'General case' 0 C--N 1.353 0.719 0 O-C-N 123.711 0.632 . . . . 74.11 110.821 -177.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.405 ' HG3' HG21 ' A' ' 68' ' ' VAL . 14.8 mmmm -73.76 -29.92 62.49 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.122 0.569 . . . . 75.13 111.52 -178.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.523 HD23 ' NE2' ' A' ' 22' ' ' GLN . 64.7 mt -71.09 -32.17 68.73 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.041 0.537 . . . . 62.5 111.41 171.215 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.9 mt -71.02 -32.42 69.18 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.306 0.642 . . . . 72.33 110.222 173.091 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 21.8 mm-40 -61.86 -44.53 96.64 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.147 0.579 . . . . 71.24 110.306 176.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.523 ' NE2' HD23 ' A' ' 19' ' ' LEU . 48.0 mt-30 -71.01 -42.91 68.96 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.109 -0.95 . . . . 61.34 111.457 -179.147 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.9 t -138.82 91.74 11.62 Favored Pre-proline 0 C--O 1.241 0.632 0 CA-C-N 116.03 -0.532 . . . . 74.11 110.483 -177.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -72.33 -12.38 27.45 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 122.925 2.417 . . . . 73.33 111.539 165.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -69.98 -25.06 63.44 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 124.685 1.194 . . . . 73.02 111.236 177.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 7.4 m -116.95 146.25 43.11 Favored 'General case' 0 C--O 1.239 0.548 0 C-N-CA 123.705 0.802 . . . . 73.23 110.758 -176.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -94.65 120.94 35.67 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 107.648 -1.242 . . . . 50.32 107.648 172.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 47.6 t -97.56 135.42 32.01 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 C-N-CA 123.812 0.845 . . . . 74.35 109.481 -173.123 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 54.8 tp60 -130.99 133.69 46.02 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.449 0.7 . . . . 73.11 109.312 -178.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.576 HG11 ' HD2' ' A' ' 12' ' ' LYS . 53.5 t -59.95 118.84 3.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 123.101 0.561 . . . . 75.13 110.463 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.489 ' H ' ' HA ' ' A' ' 44' ' ' LEU . 26.3 tpt180 -90.4 -49.47 6.5 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.514 0.726 . . . . 73.21 109.701 -173.253 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 18.8 ttt180 -160.86 151.39 18.13 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.845 0.858 . . . . 61.14 109.774 -178.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.401 HG21 ' HD3' ' A' ' 12' ' ' LYS . 64.1 t -114.97 128.43 72.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 123.62 0.768 . . . . 75.02 109.214 173.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -117.22 137.6 52.26 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 124.677 1.191 . . . . 72.11 107.897 176.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -107.54 119.99 40.95 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 107.364 -1.347 . . . . 64.42 107.364 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -130.7 75.66 1.67 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.714 0.806 . . . . 71.33 108.882 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 63.02 -114.48 6.94 Favored Glycine 0 C--N 1.348 1.21 0 CA-C-N 114.932 -1.031 . . . . 40.2 112.724 -178.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -82.89 -21.16 34.32 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.111 0.565 . . . . 54.52 110.906 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.429 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 24.7 m -100.62 104.22 15.54 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.704 0.801 . . . . 73.22 110.67 -178.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.68 HD13 ' HG3' ' A' ' 8' ' ' LYS . 77.9 mt -83.77 109.12 16.91 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 N-CA-C 108.806 -0.812 . . . . 73.14 108.806 172.598 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.571 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 64.2 mtt180 -88.84 95.46 10.3 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.133 0.973 . . . . 70.5 110.045 -179.328 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 57.0 t -87.92 110.71 21.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 N-CA-C 109.08 -0.711 . . . . 72.23 109.08 176.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -76.43 134.1 39.68 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 109.429 -0.582 . . . . 73.24 109.429 169.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.489 ' HA ' ' H ' ' A' ' 31' ' ' ARG . 4.3 mp -131.78 168.4 17.87 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.058 0.543 . . . . 53.33 109.803 174.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -110.17 130.15 55.59 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 107.615 -1.254 . . . . 72.43 107.615 -179.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.627 ' HB3' ' CE2' ' A' ' 55' ' ' TYR . 6.8 tt -139.74 135.66 33.35 Favored 'General case' 0 C--O 1.249 1.057 0 N-CA-C 106.472 -1.677 . . . . 52.02 106.472 -179.516 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 83.1 mtt180 -103.39 99.52 9.36 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.448 -0.796 . . . . 74.02 110.557 -166.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 36.3 m -72.73 87.11 1.25 Allowed 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 108.901 -0.777 . . . . 65.54 108.901 176.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 55.4 m-20 60.48 31.78 20.37 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 124.734 1.214 . . . . 65.44 110.555 -171.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.15 -10.16 59.89 Favored Glycine 0 C--N 1.351 1.404 0 CA-C-N 115.666 -0.697 . . . . 41.52 114.31 -177.079 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.567 ' HE3' ' HA ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -75.47 129.09 36.72 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 117.93 0.865 . . . . 73.44 110.362 179.065 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.78 115.65 21.1 Favored 'General case' 0 C--O 1.238 0.48 0 C-N-CA 123.599 0.76 . . . . 75.43 109.814 -172.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 14.5 mp0 -129.6 139.31 51.5 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.346 0.658 . . . . 53.31 109.722 170.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -92.56 122.55 35.09 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.913 0.885 . . . . 64.13 109.181 172.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.627 ' CE2' ' HB3' ' A' ' 46' ' ' LEU . 12.0 m-85 -107.23 116.7 32.4 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 108.472 -0.936 . . . . 74.14 108.472 179.067 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 29.8 m -88.77 99.33 12.28 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 107.589 -1.263 . . . . 73.21 107.589 177.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.561 HG13 HG12 ' A' ' 71' ' ' ILE . 47.0 t -91.84 103.64 14.75 Favored 'Isoleucine or valine' 0 C--O 1.239 0.545 0 N-CA-C 107.339 -1.356 . . . . 73.12 107.339 -178.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.571 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 43.1 mt-10 -85.44 101.66 12.8 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.136 -1.393 . . . . 70.22 108.759 -174.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.491 ' HB ' HG13 ' A' ' 11' ' ' VAL . 34.5 t -112.09 112.75 41.86 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 C-N-CA 123.985 0.914 . . . . 63.41 108.944 -175.026 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.624 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 42.1 tt0 -105.04 149.39 25.84 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.586 0.755 . . . . 72.31 111.164 -174.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -77.11 112.02 13.31 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.687 0.795 . . . . 62.12 109.188 173.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -121.21 111.69 17.71 Favored 'General case' 0 C--O 1.242 0.694 0 N-CA-C 107.891 -1.152 . . . . 73.52 107.891 171.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 75.09 -109.35 2.76 Favored Glycine 0 C--N 1.346 1.121 0 N-CA-C 110.778 -0.929 . . . . 55.11 110.778 -174.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -123.13 5.61 9.22 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.328 0.651 . . . . 62.22 109.822 176.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 67.9 p -110.54 148.0 33.02 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.382 0.673 . . . . 74.44 110.912 -176.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -96.17 112.02 23.89 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.185 0.994 . . . . 74.33 108.826 173.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.0 t -113.79 131.31 56.27 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 123.666 0.786 . . . . 72.42 110.211 -173.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.407 HG22 HG22 ' A' ' 59' ' ' VAL . 98.4 t -70.28 107.71 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 N-CA-C 109.247 -0.649 . . . . 53.51 109.247 174.264 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.624 ' HD3' ' HB3' ' A' ' 60' ' ' GLU . 30.6 mmmt -66.82 -52.83 39.19 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 115.23 -0.895 . . . . 73.44 109.498 176.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.5 ptt180 -162.71 164.9 26.2 Favored 'General case' 0 C--O 1.241 0.636 0 CA-C-N 114.508 -1.224 . . . . 51.43 109.779 -179.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.561 HG12 HG13 ' A' ' 57' ' ' VAL . 41.5 mt -121.93 107.69 20.44 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 C-N-CA 123.947 0.899 . . . . 35.15 108.606 175.527 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 36.4 m -93.22 103.82 16.05 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.6 0.76 . . . . 63.34 109.836 -176.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 36.9 ttt180 -79.43 133.89 36.55 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.012 0.525 . . . . 62.41 109.63 175.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 8.1 t -84.87 151.0 24.6 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 109.45 -0.574 . . . . 74.23 109.45 170.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 8.6 p -119.86 145.53 25.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 N-CA-C 108.604 -0.888 . . . . 74.01 108.604 177.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -65.25 -43.35 95.42 Favored Glycine 0 C--N 1.351 1.406 0 O-C-N 123.277 0.361 . . . . 42.24 112.431 -178.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.4 t -146.58 167.57 23.39 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.822 0.849 . . . . 71.23 109.765 179.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.4 pp -151.32 26.72 0.68 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.223 0.609 . . . . 55.41 111.277 -172.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -132.99 179.53 6.12 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.378 0.671 . . . . 72.35 112.368 -173.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 16.8 p80 -142.8 102.27 4.0 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 105.979 -1.86 . . . . 72.03 105.979 165.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 45.8 p-80 -64.37 140.58 58.88 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 116.033 -0.531 . . . . 70.15 111.649 -174.091 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 22.7 m170 -75.31 162.09 28.72 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 108.661 -0.866 . . . . 74.23 108.661 171.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 15.9 p-80 54.44 175.3 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.88 0 C-N-CA 126.112 1.765 . . . . 74.12 112.82 -169.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 37.5 m80 -132.47 149.92 52.25 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.474 0.71 . . . . 75.13 109.319 179.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 21.9 m-70 . . . . . 0 C--O 1.251 1.146 0 C-N-CA 123.564 0.746 . . . . 53.44 109.161 179.045 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.5 ttm . . . . . 0 N--CA 1.478 0.972 0 N-CA-C 109.561 -0.533 . . . . 74.42 109.561 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -60.76 110.96 0.91 Allowed 'Trans proline' 0 C--N 1.384 2.419 0 C-N-CA 122.391 2.06 . . . . 64.23 111.691 175.205 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 40.2 m -81.32 15.81 1.85 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 123.514 0.725 . . . . 72.23 111.726 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -49.59 -36.68 24.83 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.183 1.393 . . . . 60.22 112.748 -178.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -75.64 -36.61 60.13 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.545 0.738 . . . . 72.31 111.046 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -70.6 -22.97 62.49 Favored 'General case' 0 C--N 1.349 0.584 0 CA-C-N 115.161 -0.927 . . . . 73.13 110.376 174.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.539 ' O ' HG23 ' A' ' 11' ' ' VAL . 33.5 mm-40 -63.15 -49.76 73.05 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-O 118.988 -0.53 . . . . 74.11 110.02 177.333 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.46 -25.82 68.19 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 112.153 0.427 . . . . 75.12 112.153 178.646 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -63.65 -45.46 90.09 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.067 0.46 . . . . 75.34 109.832 172.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.401 ' O ' HG23 ' A' ' 14' ' ' VAL . 46.5 mt-30 -69.04 -37.73 78.74 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 115.229 -0.896 . . . . 72.23 110.843 177.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 7' ' ' GLU . 79.7 t -66.23 -50.68 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 123.806 0.842 . . . . 63.24 111.769 -174.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.512 ' HD3' HG21 ' A' ' 33' ' ' VAL . 34.3 mtmm -65.84 -32.86 74.62 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 123.236 0.335 . . . . 71.43 111.036 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -65.89 -53.52 38.51 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 123.728 0.642 . . . . 45.15 110.285 177.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.472 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 78.9 t -59.2 -37.72 70.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 C-N-CA 123.03 0.532 . . . . 75.43 110.351 178.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.36 -44.77 86.59 Favored 'General case' 0 C--O 1.246 0.901 0 C-N-CA 123.613 0.765 . . . . 73.51 111.899 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -71.38 -31.24 67.08 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 116.396 -0.365 . . . . 72.23 110.591 -178.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.493 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 47.1 mt-10 -65.79 -39.86 91.36 Favored 'General case' 0 C--N 1.355 0.816 0 O-C-N 123.899 0.749 . . . . 61.44 110.686 179.766 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.5 ' HB2' HD11 ' A' ' 71' ' ' ILE . 67.8 mmtt -73.21 -28.2 62.04 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-O 120.81 0.338 . . . . 72.23 110.69 178.718 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.571 ' HB3' HD12 ' A' ' 46' ' ' LEU . 53.3 mt -70.2 -31.09 68.37 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.971 0.509 . . . . 73.34 111.069 169.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.1 mt -79.68 -17.95 52.49 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.891 0.876 . . . . 65.13 110.946 175.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 8.7 mm-40 -71.63 -41.05 69.29 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 109.736 -0.468 . . . . 74.0 109.736 172.278 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.425 ' NE2' HD23 ' A' ' 19' ' ' LEU . 42.0 mt-30 -76.54 -37.25 56.94 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 115.276 -0.875 . . . . 64.41 110.554 178.293 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.3 t -153.69 86.42 3.9 Favored Pre-proline 0 CA--C 1.551 1.006 0 C-N-CA 123.693 0.797 . . . . 43.12 110.779 -173.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo -78.37 -19.22 11.91 Favored 'Trans proline' 0 C--N 1.374 1.92 0 C-N-CA 122.505 2.137 . . . . 40.02 112.629 177.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.467 HD22 ' N ' ' A' ' 25' ' ' ASN . 0.7 OUTLIER -77.44 -19.68 55.67 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.68 0.792 . . . . 73.31 111.05 -175.24 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 31.4 m -100.13 141.58 32.76 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.178 0.591 . . . . 73.12 110.047 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -77.4 119.85 21.58 Favored 'General case' 0 C--O 1.243 0.755 0 C-N-CA 124.03 0.932 . . . . 72.41 109.546 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.9 t -98.32 112.4 30.33 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 N-CA-C 109.429 -0.582 . . . . 55.34 109.429 -178.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.435 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 30.7 mm-40 -94.93 174.42 7.1 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.353 1.061 . . . . 64.33 109.367 172.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.457 HG11 ' HD2' ' A' ' 12' ' ' LYS . 47.1 t -106.38 137.21 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 N-CA-C 108.961 -0.755 . . . . 61.45 108.961 169.352 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -102.7 -54.2 2.7 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.936 0.495 . . . . 74.11 110.19 179.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -153.88 147.84 25.55 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.994 0.918 . . . . 72.22 109.103 -176.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.531 HG13 HG22 ' A' ' 42' ' ' VAL . 88.1 t -121.51 118.83 57.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 N-CA-C 108.347 -0.983 . . . . 64.15 108.347 176.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -116.66 109.87 17.75 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.146 0.578 . . . . 63.34 109.743 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.52 ' HG2' HG12 ' A' ' 40' ' ' ILE . 2.8 tmtp? -83.65 117.25 23.06 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 107.138 -1.43 . . . . 75.12 107.138 178.664 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.0 89.88 2.81 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 108.983 -0.747 . . . . 71.41 108.983 -178.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.407 ' O ' ' HE2' ' A' ' 35' ' ' LYS . . . 69.08 -111.46 3.94 Favored Glycine 0 C--N 1.344 1.023 0 O-C-N 123.612 0.57 . . . . 74.12 113.464 173.41 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -96.92 1.14 50.09 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.29 0.636 . . . . 73.42 111.388 177.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 23.7 m -131.24 107.88 9.3 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.327 0.651 . . . . 71.3 110.211 -176.143 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.535 HD12 HG21 ' A' ' 11' ' ' VAL . 33.7 mt -83.62 107.46 15.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 N-CA-C 108.497 -0.927 . . . . 71.45 108.497 172.089 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.527 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 98.1 mtt180 -86.36 95.27 9.6 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 109.008 -0.738 . . . . 75.11 109.008 176.097 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.531 HG22 HG13 ' A' ' 33' ' ' VAL . 58.5 t -86.73 113.48 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 N-CA-C 108.762 -0.829 . . . . 64.43 108.762 177.194 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -86.98 104.42 16.28 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 124.087 0.955 . . . . 64.31 108.518 174.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.435 ' HB3' ' O ' ' A' ' 29' ' ' GLN . 4.8 mp -97.24 165.93 11.81 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 109.754 -0.461 . . . . 52.5 109.754 179.393 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -116.64 104.85 11.8 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.119 0.485 . . . . 72.42 109.983 -179.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.571 HD12 ' HB3' ' A' ' 19' ' ' LEU . 6.8 tt -107.42 129.39 54.94 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 106.927 -1.508 . . . . 73.4 106.927 177.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 55.8 mtm180 -99.95 102.17 13.48 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 108.48 -0.933 . . . . 61.41 108.48 -178.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.513 HG22 HD22 ' A' ' 49' ' ' ASN . 25.4 m -94.74 107.15 19.16 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.418 1.087 . . . . 62.41 109.686 -175.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.513 HD22 HG22 ' A' ' 48' ' ' THR . 50.2 m-80 61.31 27.68 17.31 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 124.065 0.946 . . . . 74.43 112.06 179.377 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 97.65 -19.56 54.17 Favored Glycine 0 C--N 1.347 1.153 0 CA-C-N 116.119 -0.491 . . . . 51.21 112.98 -178.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 45.0 mtmt -74.09 124.43 26.28 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 109.288 -0.634 . . . . 74.22 109.288 177.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -82.35 110.86 17.88 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 108.562 -0.903 . . . . 72.3 108.562 178.104 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -126.26 145.38 50.43 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.17 0.588 . . . . 75.13 110.17 -177.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -108.32 129.98 55.21 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.207 0.603 . . . . 52.54 109.421 177.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.467 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 42.0 m-85 -113.91 118.93 35.58 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 108.911 -0.774 . . . . 73.14 108.911 179.085 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 31.9 m -83.57 101.45 11.47 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 108.948 -0.76 . . . . 34.34 108.948 176.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.464 HG13 HG12 ' A' ' 71' ' ' ILE . 48.0 t -94.91 110.38 23.81 Favored 'Isoleucine or valine' 0 C--O 1.239 0.514 0 CA-C-N 115.24 -0.891 . . . . 72.5 109.274 179.362 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.527 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 37.3 mt-10 -78.66 106.35 10.58 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.961 0.904 . . . . 70.1 109.089 177.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.549 HG22 HG22 ' A' ' 68' ' ' VAL . 41.6 t -111.65 114.36 46.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 N-CA-C 108.657 -0.868 . . . . 73.42 108.657 178.009 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -102.26 155.88 17.93 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.279 1.032 . . . . 64.0 110.781 -171.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.448 ' NH2' ' HA ' ' A' ' 64' ' ' ASN . 14.6 tpt180 -89.35 133.09 34.65 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.637 0.775 . . . . 75.15 110.146 -177.216 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -141.22 91.85 2.43 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 108.729 -0.841 . . . . 74.41 108.729 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.94 -102.78 1.03 Allowed Glycine 0 C--N 1.345 1.031 0 CA-C-N 116.095 -0.502 . . . . 44.52 112.707 179.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.448 ' HA ' ' NH2' ' A' ' 61' ' ' ARG . 19.8 m-80 -115.15 1.94 13.99 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.158 0.983 . . . . 73.14 111.174 177.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 71.5 p -115.51 166.63 11.68 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.812 0.845 . . . . 72.44 110.769 -178.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -117.65 136.37 53.37 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.116 0.966 . . . . 73.45 108.77 174.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 6.2 t -126.01 122.38 35.72 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.004 0.921 . . . . 64.44 110.048 -175.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.549 HG22 HG22 ' A' ' 59' ' ' VAL . 86.2 t -73.59 115.83 15.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 122.593 0.357 . . . . 72.12 110.203 178.23 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -74.57 -57.07 4.16 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.028 0.931 . . . . 73.44 110.441 178.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -160.47 148.2 16.2 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 116.174 -0.466 . . . . 72.32 110.683 -178.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.5 HD11 ' HB2' ' A' ' 18' ' ' LYS . 47.0 mt -105.44 106.78 21.16 Favored 'Isoleucine or valine' 0 C--O 1.24 0.596 0 N-CA-C 108.608 -0.886 . . . . 63.51 108.608 168.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 66.7 m -109.57 115.59 30.18 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.683 0.793 . . . . 72.24 108.92 176.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.467 ' HA ' ' HA ' ' A' ' 55' ' ' TYR . 49.4 ttp180 -68.38 145.66 53.94 Favored 'General case' 0 C--O 1.243 0.722 0 N-CA-C 109.473 -0.566 . . . . 63.15 109.473 176.283 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 14.6 t -62.3 134.95 57.2 Favored 'General case' 0 C--O 1.242 0.69 0 O-C-N 123.863 0.727 . . . . 72.11 110.081 -179.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 11.4 p -92.02 152.09 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 C-N-CA 123.194 0.598 . . . . 63.23 109.444 179.232 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -165.43 45.3 0.28 Allowed Glycine 0 C--N 1.339 0.71 0 N-CA-C 111.076 -0.81 . . . . 63.13 111.076 178.393 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.3 t -81.16 -173.8 4.52 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.622 0.769 . . . . 63.24 110.56 -177.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 96.5 mt -73.72 75.68 1.55 Allowed 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 121.424 0.63 . . . . 74.31 109.697 175.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -106.02 166.78 10.25 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.442 -0.799 . . . . 75.15 110.404 -174.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 -71.36 96.76 1.5 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.889 0.876 . . . . 73.33 111.114 -174.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -69.3 130.52 42.82 Favored 'General case' 0 C--O 1.242 0.663 0 C-N-CA 123.645 0.778 . . . . 74.35 109.094 176.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 86.3 t60 63.11 84.88 0.14 Allowed 'General case' 0 CA--C 1.549 0.926 0 O-C-N 124.567 1.167 . . . . 73.41 110.211 -169.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -126.33 13.92 7.7 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.26 1.024 . . . . 70.35 111.084 -175.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 26.2 p80 -149.46 157.54 43.38 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.413 0.685 . . . . 75.31 109.963 171.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 41.6 m-70 . . . . . 0 N--CA 1.477 0.894 0 C-N-CA 123.778 0.831 . . . . 71.13 110.11 175.633 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.6 mtt . . . . . 0 N--CA 1.483 1.192 0 CA-C-O 119.384 -0.341 . . . . 74.43 110.137 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -67.88 113.95 3.19 Favored 'Trans proline' 0 C--N 1.382 2.308 0 C-N-CA 122.866 2.378 . . . . 74.44 112.759 -176.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.6 t -81.35 178.91 8.09 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.527 0.731 . . . . 61.32 111.192 176.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -60.78 -24.17 65.58 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.172 0.589 . . . . 72.32 111.453 173.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -70.43 -42.57 71.38 Favored 'General case' 0 C--O 1.242 0.695 0 C-N-CA 123.171 0.588 . . . . 72.3 110.391 175.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.5 mm-40 -63.88 -21.12 66.31 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 112.744 0.646 . . . . 74.02 112.744 -176.045 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.575 ' O ' HG23 ' A' ' 11' ' ' VAL . 77.2 mt-10 -57.14 -56.89 15.95 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 124.085 0.866 . . . . 74.54 109.407 170.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -69.21 -32.21 71.32 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.257 0.623 . . . . 73.33 110.71 -176.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 29.8 mmt180 -55.45 -48.98 73.63 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.564 0.746 . . . . 62.2 110.122 174.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.547 ' O ' HG23 ' A' ' 14' ' ' VAL . 64.7 mt-30 -64.32 -45.38 88.15 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 114.26 -1.336 . . . . 70.31 111.16 178.172 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.619 HG21 HD12 ' A' ' 40' ' ' ILE . 59.0 t -61.53 -44.51 98.72 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 123.23 0.612 . . . . 73.33 111.899 -176.044 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt -65.19 -34.25 77.94 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.092 0.557 . . . . 71.01 110.24 178.27 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.48 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 8.5 tt0 -64.59 -51.7 61.33 Favored 'General case' 0 C--N 1.352 0.704 0 CA-C-N 115.656 -0.702 . . . . 72.5 110.418 175.192 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.547 HG23 ' O ' ' A' ' 10' ' ' GLN . 45.0 t -56.5 -46.75 82.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 C-N-CA 123.129 0.572 . . . . 74.12 109.578 -179.307 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.454 ' HB1' HD11 ' A' ' 44' ' ' LEU . . . -60.23 -47.5 85.72 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 114.896 -1.047 . . . . 62.41 112.29 -179.305 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -71.1 -35.4 71.8 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 122.822 0.449 . . . . 74.45 111.321 -175.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 36.4 mm-40 -69.09 -34.6 75.35 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.933 0.493 . . . . 75.51 111.021 -179.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.606 ' HB3' HD11 ' A' ' 71' ' ' ILE . 75.2 mmtt -68.16 -35.43 78.06 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.955 0.502 . . . . 70.31 111.063 176.102 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.551 ' HB3' HD12 ' A' ' 46' ' ' LEU . 29.8 mt -68.05 -31.84 71.78 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 115.518 -0.764 . . . . 74.33 111.291 174.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 84.9 mt -73.75 -26.11 60.5 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.927 0.891 . . . . 73.4 111.268 174.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 62.9 mm-40 -66.94 -40.68 87.63 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.652 0.381 . . . . 73.1 110.288 173.309 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -72.89 -40.92 65.19 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 123.892 0.745 . . . . 74.13 111.087 178.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.2 t -142.68 99.79 5.64 Favored Pre-proline 0 CA--C 1.548 0.867 0 CA-C-N 115.358 -0.837 . . . . 63.45 109.349 -175.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -79.61 -3.5 12.95 Favored 'Trans proline' 0 C--N 1.38 2.219 0 C-N-CA 122.598 2.198 . . . . 74.43 111.995 171.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -101.07 21.63 13.55 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.015 1.326 . . . . 74.55 110.269 -179.29 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 92.9 p -125.89 153.46 44.16 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 112.321 0.489 . . . . 51.42 112.321 -175.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -96.76 121.98 39.21 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 108.327 -0.99 . . . . 54.11 108.327 164.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 38.7 t -100.95 113.21 36.27 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 122.919 0.488 . . . . 73.12 109.739 177.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -96.74 159.4 14.95 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.225 1.01 . . . . 71.31 108.752 170.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.6 p -98.85 118.3 45.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 N-CA-C 108.413 -0.958 . . . . 72.04 108.413 170.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 21.8 tpt180 -85.78 -57.65 2.96 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 123.035 0.534 . . . . 72.12 110.429 -174.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.0 tpt180 -156.61 144.14 19.14 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.511 0.724 . . . . 75.31 109.753 -172.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 86.0 t -127.95 122.75 59.23 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 123.139 0.576 . . . . 72.32 110.282 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -106.8 129.53 54.65 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.641 1.176 . . . . 74.52 108.863 169.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.473 ' HG2' HG12 ' A' ' 40' ' ' ILE . 13.1 tmtt? -104.88 108.08 19.38 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 106.989 -1.486 . . . . 75.24 106.989 173.191 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -122.66 93.29 3.92 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.273 0.629 . . . . 73.41 110.173 -177.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 70.08 -98.13 0.62 Allowed Glycine 0 C--N 1.35 1.346 0 CA-C-N 115.497 -0.774 . . . . 73.22 112.343 178.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 47.5 m-80 -111.08 -29.25 7.96 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.052 0.541 . . . . 72.32 110.21 173.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 19.0 m -83.97 101.47 11.74 Favored 'General case' 0 C--N 1.352 0.69 0 CA-C-O 121.112 0.482 . . . . 63.33 110.204 -178.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.619 HD12 HG21 ' A' ' 11' ' ' VAL . 31.1 mt -87.95 112.69 23.95 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 CA-C-N 115.838 -0.619 . . . . 64.52 109.533 172.538 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.498 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 90.2 mtt180 -81.84 97.77 8.18 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 123.725 0.81 . . . . 73.14 109.645 174.346 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.431 HG12 ' HG ' ' A' ' 44' ' ' LEU . 61.2 t -91.3 107.42 18.69 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 N-CA-C 107.88 -1.156 . . . . 65.54 107.88 172.137 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -82.85 122.16 27.87 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 114.984 -1.007 . . . . 74.44 108.392 168.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.454 HD11 ' HB1' ' A' ' 15' ' ' ALA . 2.5 mp -116.41 153.64 31.7 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 109.358 -0.608 . . . . 74.15 109.358 -179.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.439 ' HG3' ' HD3' ' A' ' 52' ' ' LYS . 31.2 tt0 -111.42 103.89 12.29 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 109.301 -0.629 . . . . 74.12 109.301 175.594 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.551 HD12 ' HB3' ' A' ' 19' ' ' LEU . 7.3 tt -102.38 154.0 19.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.419 1.088 . . . . 74.34 109.444 -174.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 62.9 mtp180 -129.93 97.07 4.37 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.439 0.696 . . . . 73.44 110.64 177.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 86.2 m -80.25 102.46 9.5 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 108.95 -0.759 . . . . 64.45 108.95 176.036 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 62.49 26.43 15.73 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.38 0.672 . . . . 54.03 110.859 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.6 -20.27 51.09 Favored Glycine 0 C--N 1.354 1.565 0 CA-C-N 115.758 -0.655 . . . . 21.42 113.329 -177.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -69.38 123.02 20.11 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 109.672 -0.492 . . . . 72.01 109.672 177.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.439 ' HD3' ' HG3' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -88.82 112.99 23.89 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 108.814 -0.81 . . . . 74.24 108.814 -170.828 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -128.1 111.94 14.04 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.565 1.146 . . . . 64.4 109.061 178.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -78.78 133.68 37.07 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 109.067 -0.716 . . . . 75.52 109.067 173.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.421 ' HE2' HD22 ' A' ' 46' ' ' LEU . 75.9 m-85 -114.41 171.72 7.45 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.431 0.692 . . . . 75.13 109.887 172.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 86.2 m -143.88 102.64 3.93 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 106.7 -1.593 . . . . 73.31 106.7 175.236 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.441 HG22 HG12 ' A' ' 71' ' ' ILE . 46.9 t -98.84 105.06 16.8 Favored 'Isoleucine or valine' 0 C--O 1.243 0.723 0 N-CA-C 107.608 -1.256 . . . . 74.32 107.608 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.498 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 28.1 mt-10 -80.52 102.3 9.65 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 115.442 -0.799 . . . . 74.2 109.433 178.562 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.554 HG22 HG22 ' A' ' 68' ' ' VAL . 25.9 t -105.71 115.67 47.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 C-N-CA 124.109 0.963 . . . . 72.41 108.711 -178.697 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.598 ' HB3' ' HE2' ' A' ' 69' ' ' LYS . 35.6 tt0 -102.25 154.76 18.73 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.72 0.808 . . . . 64.51 110.023 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 29.5 ttp180 -80.29 139.64 36.55 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 120.958 0.408 . . . . 64.02 111.733 177.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -127.09 103.18 7.3 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.89 1.276 . . . . 75.41 107.642 172.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 69.31 -110.76 3.52 Favored Glycine 0 CA--C 1.53 1.007 0 N-CA-C 111.533 -0.627 . . . . 71.14 111.533 -173.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -101.34 -21.62 14.8 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.01 0.524 . . . . 71.14 110.869 170.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.8 p -86.22 174.73 8.91 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.193 0.597 . . . . 62.24 110.53 -172.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 89.3 m95 -124.98 147.38 48.95 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.625 0.77 . . . . 71.11 108.936 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.2 t -145.91 135.35 23.07 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.078 0.551 . . . . 73.3 110.224 -170.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.595 HG21 ' HG3' ' A' ' 18' ' ' LYS . 70.5 t -85.08 129.76 37.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 123.62 0.768 . . . . 75.13 110.593 -176.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.598 ' HE2' ' HB3' ' A' ' 60' ' ' GLU . 74.8 mmtt -81.5 -50.39 9.46 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.916 -0.583 . . . . 62.0 109.871 175.229 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 26.9 ptt-85 -168.83 167.63 10.92 Favored 'General case' 0 C--O 1.245 0.84 0 CA-C-N 115.35 -0.841 . . . . 64.5 110.111 -177.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.606 HD11 ' HB3' ' A' ' 18' ' ' LYS . 59.5 mt -117.81 109.09 26.26 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 115.089 -0.96 . . . . 74.33 108.851 173.568 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 34.2 m -102.56 124.3 47.86 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 109.677 -0.49 . . . . 44.15 109.677 178.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 46.7 ttp180 -82.82 146.85 28.7 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 108.718 -0.845 . . . . 74.32 108.718 171.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.3 t -64.45 151.91 43.01 Favored 'General case' 0 C--O 1.247 0.929 0 C-N-CA 123.034 0.534 . . . . 54.52 110.368 172.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 7.6 p -64.03 110.74 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.042 0 CA-C-O 121.879 0.847 . . . . 63.3 108.792 173.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 155.6 150.2 5.53 Favored Glycine 0 N--CA 1.463 0.466 0 CA-C-N 114.042 -1.436 . . . . 74.44 109.891 -170.46 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 10.6 t 64.99 32.28 10.61 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.851 0.86 . . . . 74.4 110.521 -177.47 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -121.48 179.64 4.38 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.529 0.731 . . . . 63.42 110.359 -178.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -70.29 118.76 13.52 Favored 'General case' 0 C--O 1.241 0.64 0 CA-C-N 115.969 -0.56 . . . . 63.2 109.885 173.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 47.0 m80 -71.1 96.89 1.4 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 108.348 -0.982 . . . . 75.43 108.348 169.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 58.2 m80 -67.56 122.03 17.14 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.291 0.636 . . . . 71.12 110.613 -176.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 23.4 m170 -67.96 -41.68 82.06 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 108.64 -0.874 . . . . 75.01 108.64 175.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 29.7 p-80 -159.64 -170.54 2.95 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 114.167 -1.378 . . . . 75.24 108.835 176.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.9 p80 -161.34 111.28 1.65 Allowed 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.571 0.748 . . . . 61.13 109.055 174.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 25.6 p-80 . . . . . 0 C--O 1.253 1.244 0 C-N-CA 122.858 0.463 . . . . 74.42 110.853 -174.5 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.709 ' SD ' ' HA ' ' A' ' 7' ' ' GLU . 34.2 mtm . . . . . 0 N--CA 1.474 0.756 0 N-CA-C 108.842 -0.799 . . . . 72.2 108.842 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.436 ' HD2' ' HG2' ' A' ' 6' ' ' GLU . 34.8 Cg_endo -63.27 -38.86 41.46 Favored 'Trans proline' 0 C--N 1.372 1.801 0 C-N-CA 122.672 2.248 . . . . 75.24 112.954 177.243 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.6 m -138.63 -178.45 5.31 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.883 0.473 . . . . 70.5 111.166 -178.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.32 -35.98 82.65 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.904 0.882 . . . . 71.45 112.679 -169.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -64.36 -32.01 73.44 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 122.916 0.486 . . . . 74.43 111.153 -176.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.436 ' HG2' ' HD2' ' A' ' 2' ' ' PRO . 2.6 mp0 -71.84 -24.67 61.74 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 115.359 -0.837 . . . . 74.41 111.528 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.709 ' HA ' ' SD ' ' A' ' 1' ' ' MET . 51.0 mt-10 -56.43 -55.38 34.28 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 109.018 -0.734 . . . . 75.22 109.018 171.076 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.474 ' HG3' HG11 ' A' ' 33' ' ' VAL . 0.6 OUTLIER -55.91 -40.96 73.83 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 124.918 1.386 . . . . 74.32 110.368 -175.27 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 84.1 mtt-85 -55.25 -46.0 76.05 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.233 1.013 . . . . 75.03 110.66 177.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.442 ' O ' HG23 ' A' ' 14' ' ' VAL . 68.3 mm-40 -72.29 -50.89 23.61 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.423 -0.808 . . . . 62.23 110.739 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 7' ' ' GLU . 43.0 t -64.32 -35.98 75.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 124.156 0.982 . . . . 65.44 112.026 -167.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 47.2 mtmt -63.1 -41.83 99.45 Favored 'General case' 0 N--CA 1.484 1.237 0 O-C-N 123.277 0.361 . . . . 42.54 110.09 176.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.456 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 9.5 tt0 -67.3 -43.94 80.46 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 124.249 0.968 . . . . 72.11 110.315 178.554 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.489 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 98.9 t -60.58 -43.43 94.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.369 0.668 . . . . 75.14 109.682 178.297 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.06 -41.61 73.92 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 114.782 -1.099 . . . . 41.1 112.078 -174.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.403 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 21.0 ptmt -67.13 -36.86 82.78 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 123.484 0.49 . . . . 73.02 110.114 -177.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.464 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 50.8 mt-10 -58.48 -46.01 87.52 Favored 'General case' 0 C--N 1.366 1.285 0 O-C-N 124.306 1.004 . . . . 74.42 109.788 177.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.489 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 31.9 mmmt -56.3 -43.76 79.24 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 124.671 1.232 . . . . 75.43 111.014 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 43.6 mt -72.08 -29.74 64.41 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 114.948 -1.023 . . . . 72.52 111.5 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 97.7 mt -76.03 -25.23 55.45 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.293 0.637 . . . . 73.24 111.108 176.526 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 17.4 mm-40 -67.42 -35.02 78.44 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-O 121.453 0.644 . . . . 74.31 109.911 175.276 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.484 HE22 HG21 ' A' ' 71' ' ' ILE . 48.0 mt-30 -88.77 -28.6 20.38 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 114.931 -1.031 . . . . 74.24 111.336 -179.152 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.514 ' HB3' HD11 ' A' ' 46' ' ' LEU . 32.4 t -150.93 84.92 5.26 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 123.248 0.619 . . . . 73.51 110.332 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -79.73 -6.41 14.33 Favored 'Trans proline' 0 C--N 1.376 2.019 0 C-N-CA 122.78 2.32 . . . . 75.43 112.946 176.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -90.11 7.49 37.62 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.655 0.782 . . . . 72.11 111.754 -178.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 39.9 t -133.25 158.52 42.7 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.375 0.67 . . . . 74.25 109.787 176.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -99.81 131.64 45.67 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.734 0.813 . . . . 63.05 108.948 177.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 40.9 t -98.46 129.92 48.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 C-N-CA 123.669 0.787 . . . . 73.11 109.679 -178.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -108.95 163.43 13.3 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.842 1.257 . . . . 71.45 109.526 177.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.8 p -90.99 119.06 37.45 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 N-CA-C 108.936 -0.765 . . . . 74.45 108.936 172.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 32.1 tpt180 -91.08 -58.37 2.49 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 109.195 -0.669 . . . . 55.54 109.195 178.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 -150.84 163.87 37.61 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.695 1.198 . . . . 65.22 109.578 173.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.53 HG13 HG22 ' A' ' 42' ' ' VAL . 47.0 t -131.96 115.85 28.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 N-CA-C 108.235 -1.024 . . . . 63.12 108.235 172.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 24.3 mp0 -101.23 124.98 47.77 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.363 0.665 . . . . 61.41 110.309 177.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.4 tptt -95.79 111.49 23.44 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.543 1.137 . . . . 73.2 109.341 175.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.512 HE22 ' H ' ' A' ' 41' ' ' ARG . 0.0 OUTLIER -121.26 72.2 0.98 Allowed 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 108.892 -0.781 . . . . 75.53 108.892 175.941 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 59.33 -104.35 0.53 Allowed Glycine 0 C--N 1.344 0.996 0 CA-C-N 115.353 -0.84 . . . . 55.21 113.121 179.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -75.55 -41.56 54.62 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.082 0.553 . . . . 75.25 110.503 -179.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.466 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 29.0 m -95.57 117.94 31.36 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.214 0.605 . . . . 61.54 111.144 -175.217 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 38.2 mt -98.04 116.8 41.64 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 123.558 0.743 . . . . 54.41 109.235 169.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.512 ' H ' HE22 ' A' ' 36' ' ' GLN . 61.5 mtt180 -103.37 99.66 9.5 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 108.594 -0.891 . . . . 62.33 108.594 178.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.53 HG22 HG13 ' A' ' 33' ' ' VAL . 39.5 t -85.52 125.87 40.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 109.098 -0.704 . . . . 70.14 109.098 179.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -85.93 122.03 29.4 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 107.953 -1.129 . . . . 72.31 107.953 166.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.433 ' O ' ' HA ' ' A' ' 54' ' ' ASN . 4.2 mp -117.53 169.06 9.84 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.073 0.549 . . . . 53.34 109.643 178.052 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -134.19 103.0 5.58 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.224 0.535 . . . . 64.23 109.612 -174.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.514 HD11 ' HB3' ' A' ' 23' ' ' SER . 8.7 tt -110.36 134.79 51.95 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 106.831 -1.544 . . . . 64.5 106.831 178.308 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.403 ' HA ' ' O ' ' A' ' 51' ' ' LYS . 74.7 mtt85 -101.74 96.97 7.43 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.463 0.649 . . . . 51.51 110.1 -175.595 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 37.5 m -81.74 104.56 12.22 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 114.996 -1.002 . . . . 71.24 108.616 -179.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 35.4 m-80 66.34 15.17 10.01 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 124.733 1.213 . . . . 50.24 111.075 -172.371 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.54 -18.81 54.66 Favored Glycine 0 C--N 1.355 1.618 0 CA-C-O 119.563 -0.576 . . . . 74.02 113.495 -172.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.403 ' O ' ' HA ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -69.18 136.14 51.64 Favored 'General case' 0 N--CA 1.488 1.45 0 CA-C-N 117.658 0.729 . . . . 51.3 110.723 178.264 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -77.81 100.16 6.2 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.39 0.676 . . . . 61.21 109.664 -175.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -105.66 112.87 26.11 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.887 0.875 . . . . 73.35 109.457 175.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.433 ' HA ' ' O ' ' A' ' 44' ' ' LEU . 17.0 m120 -91.65 118.4 30.61 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.128 0.571 . . . . 72.13 110.239 176.68 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -108.14 120.69 43.07 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 109.043 -0.725 . . . . 71.52 109.043 177.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 57.0 m -88.31 102.41 14.82 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.841 -0.8 . . . . 74.5 108.841 173.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.403 HG13 HD13 ' A' ' 71' ' ' ILE . 96.7 t -93.22 106.09 17.56 Favored 'Isoleucine or valine' 0 C--O 1.24 0.564 0 N-CA-C 108.371 -0.974 . . . . 72.24 108.371 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -86.17 104.28 15.59 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 114.491 -1.232 . . . . 73.21 108.811 -176.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 17.5 t -113.84 128.88 70.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 124.138 0.975 . . . . 65.55 108.7 -178.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.466 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 38.2 tt0 -112.33 150.02 31.61 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.089 0.555 . . . . 62.41 110.476 -176.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.4 tpp85 -73.08 128.34 35.19 Favored 'General case' 0 C--N 1.35 0.59 0 C-N-CA 123.912 0.885 . . . . 72.24 110.649 -177.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -122.95 90.44 3.29 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 107.911 -1.144 . . . . 63.11 107.911 172.029 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 72.2 -103.32 1.29 Allowed Glycine 0 C--N 1.348 1.225 0 CA-C-N 116.127 -0.488 . . . . 54.25 112.603 -177.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -119.83 2.9 11.1 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 124.125 0.97 . . . . 74.43 110.247 173.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 18.7 p -113.5 176.59 4.96 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.519 0.728 . . . . 64.43 109.705 176.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -118.72 153.36 34.52 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.051 0.941 . . . . 74.01 111.323 -174.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 4.9 t -137.33 117.41 13.41 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.217 1.007 . . . . 64.35 108.741 175.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.7 t -69.41 108.46 1.88 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.508 0 N-CA-C 109.254 -0.647 . . . . 74.45 109.254 176.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -67.49 -57.53 6.36 Favored 'General case' 0 C--O 1.237 0.432 0 O-C-N 123.983 0.802 . . . . 63.14 110.27 177.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -151.36 141.03 21.76 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.117 -0.492 . . . . 74.2 111.329 -172.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.484 HG21 HE22 ' A' ' 22' ' ' GLN . 34.1 mm -93.46 105.43 16.82 Favored 'Isoleucine or valine' 0 C--N 1.352 0.692 0 N-CA-C 107.884 -1.154 . . . . 75.3 107.884 165.079 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 74.4 m -96.49 131.17 43.36 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 108.724 -0.843 . . . . 75.11 108.724 173.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -98.31 148.51 23.58 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 108.731 -0.84 . . . . 73.25 108.731 172.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.4 t -62.16 122.82 16.54 Favored 'General case' 0 CA--C 1.551 1.017 0 N-CA-C 109.153 -0.684 . . . . 51.45 109.153 170.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 4.3 p -74.38 99.2 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 CA-C-O 121.721 0.772 . . . . 73.32 109.515 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -100.96 -120.38 4.61 Favored Glycine 0 C--N 1.341 0.808 0 N-CA-C 110.583 -1.007 . . . . 73.02 110.583 178.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 63.8 m -72.33 97.09 1.96 Allowed 'General case' 0 C--O 1.242 0.696 0 N-CA-C 109.182 -0.673 . . . . 70.53 109.182 171.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.4 tt -144.83 106.26 4.23 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 107.131 -1.433 . . . . 44.04 107.131 -177.173 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.6 mp0 -66.85 92.29 0.22 Allowed 'General case' 0 C--O 1.242 0.675 0 N-CA-C 107.773 -1.195 . . . . 63.55 107.773 171.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -66.07 103.62 0.99 Allowed 'General case' 0 C--N 1.346 0.429 0 N-CA-C 109.213 -0.662 . . . . 73.21 109.213 178.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 8.5 t-160 -68.22 146.04 53.73 Favored 'General case' 0 C--O 1.243 0.748 0 N-CA-C 108.174 -1.047 . . . . 50.32 108.174 174.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 11.5 t-80 -49.99 -39.52 41.35 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.203 1.001 . . . . 72.32 111.612 -176.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 9.1 p80 -162.61 126.59 3.03 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 124.077 0.86 . . . . 72.23 108.843 170.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -83.53 -32.95 25.62 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 109.186 -0.672 . . . . 74.14 109.186 168.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 61.3 m80 . . . . . 0 C--O 1.247 0.932 0 C-N-CA 123.676 0.791 . . . . 61.12 110.727 -179.591 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.6 ttm . . . . . 0 N--CA 1.48 1.043 0 N-CA-C 109.376 -0.602 . . . . 64.22 109.376 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.82 -11.91 31.71 Favored 'Trans proline' 0 C--N 1.379 2.159 0 C-N-CA 123.294 2.663 . . . . 63.12 114.089 -176.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.4 m 67.65 31.43 6.04 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 125.115 1.366 . . . . 74.31 110.86 -177.182 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -68.42 -26.48 65.55 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.861 1.264 . . . . 64.11 112.1 -175.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -88.13 -28.63 21.14 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 121.89 -0.507 . . . . 72.51 110.286 176.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.47 ' HA ' ' HD3' ' A' ' 9' ' ' ARG . 37.1 tt0 -79.98 -25.48 40.33 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 116.508 -0.315 . . . . 73.3 111.759 -178.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.608 ' HG3' ' HD2' ' A' ' 8' ' ' LYS . 9.7 pt-20 -60.27 -33.95 73.04 Favored 'General case' 0 C--O 1.211 -0.958 0 CA-C-O 119.451 -0.309 . . . . 71.22 110.48 178.512 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.608 ' HD2' ' HG3' ' A' ' 7' ' ' GLU . 12.3 mptt -64.45 -43.86 92.96 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.16 0.584 . . . . 63.22 110.067 175.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.485 ' HA ' ' HE2' ' A' ' 12' ' ' LYS . 72.2 mtp180 -57.92 -43.26 86.12 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.117 0.967 . . . . 73.4 110.392 177.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.446 ' O ' HG23 ' A' ' 14' ' ' VAL . 50.8 mt-30 -64.71 -46.41 82.45 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 114.537 -1.211 . . . . 62.41 110.839 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.598 HG21 HD12 ' A' ' 40' ' ' ILE . 41.4 t -63.07 -39.7 86.21 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 124.793 1.237 . . . . 72.14 111.927 -177.148 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.485 ' HE2' ' HA ' ' A' ' 9' ' ' ARG . 49.8 mtmt -64.06 -37.5 87.67 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.54 0.736 . . . . 53.41 110.397 178.491 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -71.41 -43.67 66.35 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-N 115.552 -0.749 . . . . 75.34 110.554 179.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 10' ' ' GLN . 87.7 t -58.94 -42.3 85.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 124.036 0.934 . . . . 51.21 110.299 176.41 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.34 -48.93 68.66 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 114.825 -1.079 . . . . 42.21 111.777 -177.653 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.424 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 19.8 ptmt -67.09 -28.55 68.27 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 115.755 -0.657 . . . . 55.22 111.051 -175.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -60.56 -43.83 96.84 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.429 0.691 . . . . 75.32 111.478 176.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.502 ' HG3' HG21 ' A' ' 68' ' ' VAL . 59.3 mmtt -70.54 -26.7 63.69 Favored 'General case' 0 N--CA 1.481 1.108 0 O-C-N 123.708 0.63 . . . . 64.31 110.147 -178.579 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.705 ' HB3' HD12 ' A' ' 46' ' ' LEU . 21.8 mt -75.23 -32.06 61.04 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 115.107 -0.951 . . . . 64.51 111.22 173.481 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 95.4 mt -73.35 -21.79 60.45 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.425 0.69 . . . . 75.2 111.287 175.638 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -66.67 -36.18 81.92 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-O 121.544 0.687 . . . . 73.44 110.09 173.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.462 HE21 ' HA ' ' A' ' 19' ' ' LEU . 45.8 mt-30 -81.29 -41.51 22.02 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 114.82 -1.082 . . . . 72.41 111.069 -179.723 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.4 t -153.96 89.45 3.41 Favored Pre-proline 0 CA--C 1.554 1.114 0 C-N-CA 123.524 0.73 . . . . 73.32 109.364 -174.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.33 -26.73 10.13 Favored 'Trans proline' 0 C--N 1.375 1.943 0 C-N-CA 122.809 2.339 . . . . 73.53 113.067 177.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -68.9 -25.98 64.87 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.633 0.773 . . . . 70.52 111.298 -174.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 35.0 p -84.11 138.36 33.07 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.781 0.832 . . . . 63.5 110.845 177.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.507 ' HB3' ' NH2' ' A' ' 47' ' ' ARG . 2.7 tpmt? -82.31 111.78 18.69 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 108.432 -0.951 . . . . 64.41 108.432 175.165 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 41.0 t -97.45 120.05 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 124.062 0.945 . . . . 71.24 109.512 -173.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.431 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 84.5 mm-40 -107.27 172.18 6.97 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.261 1.024 . . . . 54.33 109.219 174.173 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.484 HG21 ' HB3' ' A' ' 12' ' ' LYS . 57.6 t -102.55 123.05 55.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 108.627 -0.879 . . . . 73.34 108.627 176.056 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.5 tpt180 -92.13 -48.13 6.88 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.152 0.581 . . . . 65.04 110.684 -174.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -149.26 145.04 26.88 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.572 1.149 . . . . 73.13 107.932 -173.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.441 HG22 HG13 ' A' ' 42' ' ' VAL . 86.3 t -125.17 130.6 73.03 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 N-CA-C 108.519 -0.919 . . . . 72.43 108.519 173.161 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -120.43 108.28 13.92 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.15 0.98 . . . . 63.33 109.415 178.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.6 tmtt? -97.16 111.97 23.97 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 108.312 -0.995 . . . . 74.13 108.312 -177.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -126.0 86.69 2.56 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.46 0.704 . . . . 72.33 109.48 -176.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 60.56 -80.77 0.01 OUTLIER Glycine 0 C--N 1.353 1.489 0 N-CA-C 115.223 0.849 . . . . 42.2 115.223 172.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -103.68 -45.81 4.7 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.181 0.993 . . . . 72.13 110.359 -177.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.543 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 8.9 m -100.33 133.69 44.37 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.231 0.613 . . . . 62.2 111.134 -175.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.598 HD12 HG21 ' A' ' 11' ' ' VAL . 32.7 mt -110.5 109.01 26.88 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.9 0 C-N-CA 123.481 0.712 . . . . 72.23 109.395 174.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 39.3 mtm180 -86.19 96.77 10.03 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 109.24 -0.652 . . . . 71.14 109.24 176.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.47 HG21 HG12 ' A' ' 11' ' ' VAL . 60.7 t -90.82 117.01 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 123.143 0.577 . . . . 73.24 109.47 176.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -91.73 115.28 27.92 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.462 1.105 . . . . 43.13 108.83 174.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.431 ' HB3' ' O ' ' A' ' 29' ' ' GLN . 4.1 mp -111.1 159.48 17.78 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 122.025 -0.422 . . . . 55.33 110.375 -176.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -106.48 107.19 18.07 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 109.184 -0.673 . . . . 72.32 109.184 178.225 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.705 HD12 ' HB3' ' A' ' 19' ' ' LEU . 7.1 tt -111.19 125.47 53.83 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 106.918 -1.512 . . . . 73.01 106.918 175.547 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.507 ' NH2' ' HB3' ' A' ' 27' ' ' LYS . 43.4 mtm180 -103.24 95.6 6.21 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 109.282 -0.636 . . . . 61.41 109.282 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 56.9 m -70.99 101.34 2.16 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.503 1.121 . . . . 63.1 110.227 -176.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 19.1 m120 60.86 26.19 16.07 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.189 0.995 . . . . 55.12 111.942 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 99.22 2.82 56.8 Favored Glycine 0 C--N 1.352 1.45 0 CA-C-O 119.545 -0.586 . . . . 53.51 113.7 -179.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -103.22 124.14 48.06 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-N 117.686 0.743 . . . . 54.35 109.831 174.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -78.91 119.34 21.95 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 122.884 0.474 . . . . 73.14 110.448 -175.24 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -134.53 122.31 22.23 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.911 1.284 . . . . 64.35 108.276 175.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -88.03 140.2 29.74 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 109.787 -0.449 . . . . 70.44 109.787 176.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -120.46 121.58 38.8 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.333 0.653 . . . . 73.32 109.562 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 24.6 m -86.97 103.72 15.61 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 108.17 -1.048 . . . . 73.1 108.17 175.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.448 HG13 HD13 ' A' ' 71' ' ' ILE . 58.7 t -102.3 114.81 42.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 124.218 1.007 . . . . 63.32 109.096 -179.181 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -89.02 101.98 14.63 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 109.063 -0.717 . . . . 73.0 109.063 179.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.59 ' HB ' HG13 ' A' ' 11' ' ' VAL . 22.2 t -105.11 109.99 29.48 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 C-N-CA 123.551 0.74 . . . . 64.33 109.273 178.055 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.543 ' HA ' ' HA ' ' A' ' 39' ' ' THR . 34.8 tt0 -102.07 144.62 30.43 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.765 1.226 . . . . 73.24 111.039 -172.043 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 7.5 tpp180 -69.73 105.81 2.87 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.643 0.777 . . . . 71.4 109.574 176.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 52.2 tp60 -97.17 86.42 3.94 Favored 'General case' 0 C--O 1.242 0.707 0 N-CA-C 108.58 -0.896 . . . . 72.3 108.58 176.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 68.71 -101.02 0.73 Allowed Glycine 0 C--N 1.348 1.2 0 CA-C-N 115.18 -0.918 . . . . 54.13 111.168 -175.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -100.37 -33.05 10.54 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.67 1.188 . . . . 60.42 110.25 176.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 24.8 p -86.32 177.38 7.49 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.878 0.871 . . . . 64.52 110.814 -178.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -111.78 158.94 18.77 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.059 0.944 . . . . 73.41 109.038 172.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.5 t -145.99 137.65 24.98 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.675 0.79 . . . . 73.42 109.13 179.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.502 HG21 ' HG3' ' A' ' 18' ' ' LYS . 96.7 t -86.03 115.12 26.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 N-CA-C 108.94 -0.763 . . . . 64.31 108.94 176.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -74.89 -49.74 19.32 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 124.297 1.039 . . . . 61.33 110.25 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.1 ptp85 -157.89 159.92 37.1 Favored 'General case' 0 C--O 1.244 0.792 0 CA-C-N 115.228 -0.896 . . . . 73.03 111.277 177.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.448 HD13 HG13 ' A' ' 57' ' ' VAL . 36.4 mm -114.41 122.98 69.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 N-CA-C 106.508 -1.664 . . . . 73.33 106.508 167.281 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 11.7 t -126.98 133.93 50.48 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 109.116 -0.698 . . . . 75.2 109.116 171.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 22.1 ttm180 -91.92 140.33 29.78 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.382 -0.97 . . . . 74.13 108.382 176.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.3 t -69.87 122.56 19.5 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 108.533 -0.914 . . . . 64.41 108.533 171.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 7.6 p -69.15 112.44 3.93 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.961 0 CA-C-O 121.566 0.698 . . . . 74.3 110.057 -176.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -134.16 -38.36 0.21 Allowed Glycine 0 C--N 1.341 0.827 0 N-CA-C 110.112 -1.195 . . . . 43.22 110.112 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 30.0 t -142.18 114.81 8.51 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 108.188 -1.042 . . . . 52.32 108.188 172.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -66.72 162.71 20.7 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.42 0.688 . . . . 71.1 110.291 175.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -66.19 84.25 0.09 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.064 0.546 . . . . 65.31 111.059 177.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 59.4 t60 -78.24 86.57 4.34 Favored 'General case' 0 C--O 1.244 0.795 0 N-CA-C 106.747 -1.575 . . . . 61.33 106.747 168.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 -67.65 133.0 48.58 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 115.374 -0.83 . . . . 70.21 109.251 -178.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 11.5 m170 -65.48 -34.83 79.19 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.144 0.978 . . . . 74.25 111.506 -168.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 48.4 m80 55.38 77.77 0.21 Allowed 'General case' 0 N--CA 1.478 0.931 0 O-C-N 124.281 0.988 . . . . 44.53 110.728 178.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -131.36 155.08 47.86 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.956 -0.566 . . . . 74.21 109.933 -175.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 28.4 p-80 . . . . . 0 C--O 1.25 1.105 0 C-N-CA 123.838 0.855 . . . . 45.51 110.314 -177.786 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 mpt? . . . . . 0 N--CA 1.486 1.334 0 N-CA-C 109.435 -0.58 . . . . 72.42 109.435 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -69.19 -30.5 24.84 Favored 'Trans proline' 0 C--N 1.381 2.269 0 C-N-CA 123.138 2.559 . . . . 75.03 113.675 -175.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.45 ' O ' ' HG2' ' A' ' 7' ' ' GLU . 49.0 m 62.3 21.94 12.85 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.846 1.259 . . . . 62.11 112.609 -175.507 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -57.89 -52.37 65.76 Favored 'General case' 0 C--N 1.359 1.021 0 C-N-CA 123.32 0.648 . . . . 75.13 111.526 -174.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -60.13 -42.62 95.19 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 115.356 -0.838 . . . . 72.45 110.715 -178.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -59.39 -33.94 71.83 Favored 'General case' 0 C--N 1.349 0.586 0 C-N-CA 124.422 1.089 . . . . 71.12 111.428 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.537 ' O ' HG23 ' A' ' 11' ' ' VAL . 6.4 mm-40 -58.03 -55.53 33.7 Favored 'General case' 0 C--N 1.347 0.475 0 O-C-N 123.634 0.584 . . . . 72.31 110.13 176.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -33.37 75.81 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 123.099 0.25 . . . . 62.23 111.309 179.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 20.5 mtp180 -65.16 -33.74 76.72 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 122.871 0.468 . . . . 74.42 110.786 178.403 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.423 ' O ' HG23 ' A' ' 14' ' ' VAL . 48.3 mt-30 -68.62 -49.63 57.74 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.362 0.665 . . . . 71.42 109.694 171.643 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.566 HG13 ' HB ' ' A' ' 59' ' ' VAL . 89.9 t -64.16 -46.3 93.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 123.543 0.737 . . . . 62.13 112.562 -171.057 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.475 ' HD3' HG21 ' A' ' 33' ' ' VAL . 50.5 mtmt -64.97 -36.04 83.13 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.364 0.666 . . . . 73.5 110.715 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.565 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 8.8 tt0 -66.43 -55.63 14.83 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.022 -0.99 . . . . 73.12 109.661 177.517 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.504 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 75.5 t -52.9 -43.16 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 123.439 0.695 . . . . 72.23 110.086 177.033 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.87 -45.06 91.05 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-N 115.065 -0.97 . . . . 75.34 111.787 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.414 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 19.6 ptmt -74.48 -28.47 61.03 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.259 -0.428 . . . . 60.12 110.873 -178.776 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 13' ' ' GLN . 19.2 mm-40 -65.83 -35.78 81.63 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 123.43 0.456 . . . . 73.24 110.144 176.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.607 ' HG3' HG21 ' A' ' 68' ' ' VAL . 28.6 mmmt -73.37 -31.0 63.67 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 115.564 -0.744 . . . . 71.52 110.934 178.321 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.829 ' HB3' HD12 ' A' ' 46' ' ' LEU . 26.6 mt -74.42 -26.68 60.22 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.589 -0.732 . . . . 73.24 111.136 172.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 16' ' ' LYS . 88.3 mt -77.85 -18.94 55.72 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.24 0.616 . . . . 55.22 110.576 172.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -69.79 -38.38 76.63 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.966 0.506 . . . . 74.2 110.515 170.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -76.38 -35.44 58.64 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 115.649 -0.705 . . . . 74.23 110.569 176.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 37.9 t -158.48 96.1 1.84 Allowed Pre-proline 0 CA--C 1.552 1.057 0 C-N-CA 123.259 0.624 . . . . 60.22 110.168 -176.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -77.96 -15.57 14.77 Favored 'Trans proline' 0 C--N 1.38 2.203 0 C-N-CA 123.057 2.505 . . . . 62.33 113.262 -177.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -88.84 -20.65 24.37 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.871 0.868 . . . . 63.44 111.422 -174.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 83.6 p -82.36 158.71 23.26 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.381 0.672 . . . . 74.12 112.744 -172.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -81.06 120.79 25.26 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.624 -0.717 . . . . 74.25 109.476 167.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 39.6 t -110.52 113.91 45.58 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 N-CA-C 108.254 -1.017 . . . . 74.21 108.254 172.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 56.1 tp60 -108.99 145.51 35.4 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.223 1.009 . . . . 73.35 108.743 177.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.2 p -71.26 127.78 33.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.951 0 N-CA-C 109.457 -0.572 . . . . 73.03 109.457 172.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.4 tpt180 -95.54 -62.11 1.35 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 122.657 0.383 . . . . 73.52 110.076 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -151.97 161.44 42.63 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.146 0.979 . . . . 71.4 109.733 -177.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.475 HG21 ' HD3' ' A' ' 12' ' ' LYS . 88.7 t -137.86 119.09 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 C-N-CA 123.911 0.885 . . . . 71.02 109.841 -176.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.727 ' HB3' HE21 ' A' ' 36' ' ' GLN . 21.1 mp0 -120.74 112.65 19.11 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.108 0.963 . . . . 71.13 109.611 -178.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.548 ' HG2' HG12 ' A' ' 40' ' ' ILE . 12.6 tmtt? -83.18 105.17 13.94 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 108.112 -1.069 . . . . 71.43 108.112 178.329 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.727 HE21 ' HB3' ' A' ' 34' ' ' GLN . 84.6 mm-40 -117.45 93.32 4.12 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.725 0.81 . . . . 71.51 110.167 -173.166 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 74.53 -95.68 0.89 Allowed Glycine 0 C--N 1.346 1.102 0 CA-C-N 116.193 -0.458 . . . . 54.53 112.432 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -118.68 -17.82 9.15 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.584 0.753 . . . . 64.02 109.583 172.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.466 ' HA ' ' HA ' ' A' ' 60' ' ' GLU . 11.9 m -93.38 106.03 18.04 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.192 0.997 . . . . 74.01 110.353 -177.348 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.554 HD12 HG21 ' A' ' 11' ' ' VAL . 52.7 mt -80.98 108.29 14.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 N-CA-C 108.968 -0.753 . . . . 64.43 108.968 170.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.546 ' HG2' ' HG2' ' A' ' 58' ' ' GLU . 80.8 mtt180 -80.82 100.69 8.94 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.21 -0.905 . . . . 75.13 109.076 174.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 35.9 t -92.38 111.12 23.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 108.356 -0.979 . . . . 62.44 108.356 173.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -77.84 126.02 30.22 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 108.801 -0.814 . . . . 75.12 108.801 167.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -129.78 156.32 44.52 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 108.941 -0.763 . . . . 65.34 108.941 174.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -116.95 106.86 13.88 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.444 1.098 . . . . 74.1 108.652 -174.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.829 HD12 ' HB3' ' A' ' 19' ' ' LEU . 6.9 tt -107.15 140.96 39.17 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 125.172 1.389 . . . . 72.35 108.532 -173.499 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.487 ' HA ' ' HA ' ' A' ' 52' ' ' LYS . 29.9 mtm180 -102.09 95.33 6.27 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 109.49 -0.559 . . . . 72.31 109.49 178.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 7.1 m -84.52 100.75 11.57 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.497 0.719 . . . . 71.24 110.269 -177.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 61.1 t30 67.74 18.47 9.78 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 124.156 0.982 . . . . 72.13 111.456 172.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 99.9 -12.38 60.79 Favored Glycine 0 C--N 1.348 1.245 0 CA-C-N 116.283 -0.417 . . . . 75.21 112.863 -175.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 27.4 mmmt -91.06 121.29 32.73 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 108.567 -0.901 . . . . 75.22 108.567 167.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 47' ' ' ARG . 39.1 ttpt -99.38 121.53 41.24 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 109.56 -0.533 . . . . 61.22 109.56 -174.414 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -125.3 149.37 48.13 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 123.647 0.779 . . . . 52.55 110.86 -174.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -90.04 118.75 29.83 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.407 -0.815 . . . . 75.14 109.894 176.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -109.14 167.22 10.26 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.929 0.892 . . . . 65.35 109.506 173.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 42.7 m -144.62 105.08 4.11 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 108.538 -0.912 . . . . 75.22 108.538 177.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 42.4 t -92.71 104.98 16.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.621 0 N-CA-C 108.234 -1.024 . . . . 72.11 108.234 179.045 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.546 ' HG2' ' HG2' ' A' ' 41' ' ' ARG . 32.1 mt-10 -78.35 106.57 10.37 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 113.88 -1.509 . . . . 73.43 108.58 179.273 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.566 ' HB ' HG13 ' A' ' 11' ' ' VAL . 47.0 t -115.3 113.19 42.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 C-N-CA 123.684 0.794 . . . . 74.11 109.518 -176.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.534 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 32.2 tt0 -102.93 149.37 24.59 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.884 0.874 . . . . 62.13 110.483 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -67.97 129.98 41.58 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.112 0.565 . . . . 63.35 111.05 179.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 56.8 tp60 -119.05 79.86 1.46 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.88 0.872 . . . . 75.12 109.005 175.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 70.46 -100.75 0.83 Allowed Glycine 0 CA--C 1.531 1.065 0 CA-C-N 115.671 -0.695 . . . . 73.13 112.514 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -99.13 -28.0 13.56 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.844 0.857 . . . . 71.13 110.667 -179.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 8.9 t -100.82 172.13 7.25 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.522 0.729 . . . . 52.21 110.462 -178.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 94.3 m95 -107.52 151.52 25.47 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.485 0.714 . . . . 72.43 109.23 173.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 14.7 t -137.46 149.09 46.58 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.854 0.462 . . . . 64.43 110.631 -179.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.607 HG21 ' HG3' ' A' ' 18' ' ' LYS . 67.2 t -92.46 111.34 24.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 C-N-CA 123.671 0.788 . . . . 72.13 109.639 -175.661 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.534 ' HD3' ' HB3' ' A' ' 60' ' ' GLU . 30.7 mmmt -69.85 -57.84 4.59 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.751 0.82 . . . . 75.44 110.42 177.247 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.0 tpt180 -160.39 135.93 8.16 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.934 -0.575 . . . . 74.43 111.222 -178.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.58 HD11 ' HB3' ' A' ' 18' ' ' LYS . 56.8 mt -89.11 103.84 14.37 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 N-CA-C 107.388 -1.338 . . . . 74.32 107.388 164.226 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 86.0 m -99.89 114.68 28.07 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.488 0.715 . . . . 53.33 109.558 178.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 65.9 ttt180 -72.77 144.9 47.4 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 108.885 -0.783 . . . . 74.23 108.885 169.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 12.2 t -68.46 141.26 55.68 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 108.782 -0.821 . . . . 63.43 108.782 171.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 24.7 t -69.13 100.28 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 N-CA-C 108.643 -0.873 . . . . 71.03 108.643 -176.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -69.99 -57.64 6.85 Favored Glycine 0 C--N 1.347 1.158 0 N-CA-C 111.373 -0.691 . . . . 51.42 111.373 177.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 70.3 m -154.77 157.96 38.77 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 124.067 0.947 . . . . 74.23 109.421 173.565 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -155.58 171.22 20.31 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.21 1.004 . . . . 70.04 108.86 175.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -137.23 142.58 42.05 Favored 'General case' 0 C--O 1.242 0.684 0 C-N-CA 123.453 0.701 . . . . 64.02 109.474 -178.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 14.8 p-80 -76.46 166.51 23.32 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 109.796 -0.446 . . . . 74.51 109.796 177.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -80.09 140.07 36.61 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 109.296 -0.631 . . . . 63.12 109.296 172.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 34.1 p80 -61.07 -18.07 55.92 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 124.131 0.972 . . . . 74.5 112.834 -171.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 19.8 t-80 -129.56 103.4 6.85 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 108.532 -0.914 . . . . 74.41 108.532 176.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 44.5 t60 -129.54 103.04 6.65 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 122.824 0.45 . . . . 72.11 110.08 179.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 76.7 t60 . . . . . 0 C--O 1.251 1.182 0 N-CA-C 107.808 -1.182 . . . . 70.41 107.808 169.229 . . . . . . . . 0 0 . 1 stop_ save_